BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Date of publication Date in BindingDB Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID PubChem SID ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence 1 PDB ID(s) of Target Chain 1 UniProt (SwissProt) Recommended Name of Target Chain 1 UniProt (SwissProt) Entry Name of Target Chain 1 UniProt (SwissProt) Primary ID of Target Chain 1 UniProt (SwissProt) Secondary ID(s) of Target Chain 1 UniProt (SwissProt) Alternative ID(s) of Target Chain 1 UniProt (TrEMBL) Submitted Name of Target Chain 1 UniProt (TrEMBL) Entry Name of Target Chain 1 UniProt (TrEMBL) Primary ID of Target Chain 1 UniProt (TrEMBL) Secondary ID(s) of Target Chain 1 UniProt (TrEMBL) Alternative ID(s) of Target Chain 1 BindingDB Target Chain Sequence 2 PDB ID(s) of Target Chain 2 UniProt (SwissProt) Recommended Name of Target Chain 2 UniProt (SwissProt) Entry Name of Target Chain 2 UniProt (SwissProt) Primary ID of Target Chain 2 UniProt (SwissProt) Secondary ID(s) of Target Chain 2 UniProt (SwissProt) Alternative ID(s) of Target Chain 2 UniProt (TrEMBL) Submitted Name of Target Chain 2 UniProt (TrEMBL) Entry Name of Target Chain 2 UniProt (TrEMBL) Primary ID of Target Chain 2 UniProt (TrEMBL) Secondary ID(s) of Target Chain 2 UniProt (TrEMBL) Alternative ID(s) of Target Chain 2 BindingDB Target Chain Sequence 3 PDB ID(s) of Target Chain 3 UniProt (SwissProt) Recommended Name of Target Chain 3 UniProt (SwissProt) Entry Name of Target Chain 3 UniProt (SwissProt) Primary ID of Target Chain 3 UniProt (SwissProt) Secondary ID(s) of Target Chain 3 UniProt (SwissProt) Alternative ID(s) of Target Chain 3 UniProt (TrEMBL) Submitted Name of Target Chain 3 UniProt (TrEMBL) Entry Name of Target Chain 3 UniProt (TrEMBL) Primary ID of Target Chain 3 UniProt (TrEMBL) Secondary ID(s) of Target Chain 3 UniProt (TrEMBL) Alternative ID(s) of Target Chain 3 BindingDB Target Chain Sequence 4 PDB ID(s) of Target Chain 4 UniProt (SwissProt) Recommended Name of Target Chain 4 UniProt (SwissProt) Entry Name of Target Chain 4 UniProt (SwissProt) Primary ID of Target Chain 4 UniProt (SwissProt) Secondary ID(s) of Target Chain 4 UniProt (SwissProt) Alternative ID(s) of Target Chain 4 UniProt (TrEMBL) Submitted Name of Target Chain 4 UniProt (TrEMBL) Entry Name of Target Chain 4 UniProt (TrEMBL) Primary ID of Target Chain 4 UniProt (TrEMBL) Secondary ID(s) of Target Chain 4 UniProt (TrEMBL) Alternative ID(s) of Target Chain 4 BindingDB Target Chain Sequence 5 PDB ID(s) of Target Chain 5 UniProt (SwissProt) Recommended Name of Target Chain 5 UniProt (SwissProt) Entry Name of Target Chain 5 UniProt (SwissProt) Primary ID of Target Chain 5 UniProt (SwissProt) Secondary ID(s) of Target Chain 5 UniProt (SwissProt) Alternative ID(s) of Target Chain 5 UniProt (TrEMBL) Submitted Name of Target Chain 5 UniProt (TrEMBL) Entry Name of Target Chain 5 UniProt (TrEMBL) Primary ID of Target Chain 5 UniProt (TrEMBL) Secondary ID(s) of Target Chain 5 UniProt (TrEMBL) Alternative ID(s) of Target Chain 5 BindingDB Target Chain Sequence 6 PDB ID(s) of Target Chain 6 UniProt (SwissProt) Recommended Name of Target Chain 6 UniProt (SwissProt) Entry Name of Target Chain 6 UniProt (SwissProt) Primary ID of Target Chain 6 UniProt (SwissProt) Secondary ID(s) of Target Chain 6 UniProt (SwissProt) Alternative ID(s) of Target Chain 6 UniProt (TrEMBL) Submitted Name of Target Chain 6 UniProt (TrEMBL) Entry Name of Target Chain 6 UniProt (TrEMBL) Primary ID of Target Chain 6 UniProt (TrEMBL) Secondary ID(s) of Target Chain 6 UniProt (TrEMBL) Alternative ID(s) of Target Chain 6 BindingDB Target Chain Sequence 7 PDB ID(s) of Target Chain 7 UniProt (SwissProt) Recommended Name of Target Chain 7 UniProt (SwissProt) Entry Name of Target Chain 7 UniProt (SwissProt) Primary ID of Target Chain 7 UniProt (SwissProt) Secondary ID(s) of Target Chain 7 UniProt (SwissProt) Alternative ID(s) of Target Chain 7 UniProt (TrEMBL) Submitted Name of Target Chain 7 UniProt (TrEMBL) Entry Name of Target Chain 7 UniProt (TrEMBL) Primary ID of Target Chain 7 UniProt (TrEMBL) Secondary ID(s) of Target Chain 7 UniProt (TrEMBL) Alternative ID(s) of Target Chain 7 BindingDB Target Chain Sequence 8 PDB ID(s) of Target Chain 8 UniProt (SwissProt) Recommended Name of Target Chain 8 UniProt (SwissProt) Entry Name of Target Chain 8 UniProt (SwissProt) Primary ID of Target Chain 8 UniProt (SwissProt) Secondary ID(s) of Target Chain 8 UniProt (SwissProt) Alternative ID(s) of Target Chain 8 UniProt (TrEMBL) Submitted Name of Target Chain 8 UniProt (TrEMBL) Entry Name of Target Chain 8 UniProt (TrEMBL) Primary ID of Target Chain 8 UniProt (TrEMBL) Secondary ID(s) of Target Chain 8 UniProt (TrEMBL) Alternative ID(s) of Target Chain 8 BindingDB Target Chain Sequence 9 PDB ID(s) of Target Chain 9 UniProt (SwissProt) Recommended Name of Target Chain 9 UniProt (SwissProt) Entry Name of Target Chain 9 UniProt (SwissProt) Primary ID of Target Chain 9 UniProt (SwissProt) Secondary ID(s) of Target Chain 9 UniProt (SwissProt) Alternative ID(s) of Target Chain 9 UniProt (TrEMBL) Submitted Name of Target Chain 9 UniProt (TrEMBL) Entry Name of Target Chain 9 UniProt (TrEMBL) Primary ID of Target Chain 9 UniProt (TrEMBL) Secondary ID(s) of Target Chain 9 UniProt (TrEMBL) Alternative ID(s) of Target Chain 9 BindingDB Target Chain Sequence 10 PDB ID(s) of Target Chain 10 UniProt (SwissProt) Recommended Name of Target Chain 10 UniProt (SwissProt) Entry Name of Target Chain 10 UniProt (SwissProt) Primary ID of Target Chain 10 UniProt (SwissProt) Secondary ID(s) of Target Chain 10 UniProt (SwissProt) Alternative ID(s) of Target Chain 10 UniProt (TrEMBL) Submitted Name of Target Chain 10 UniProt (TrEMBL) Entry Name of Target Chain 10 UniProt (TrEMBL) Primary ID of Target Chain 10 UniProt (TrEMBL) Secondary ID(s) of Target Chain 10 UniProt (TrEMBL) Alternative ID(s) of Target Chain 10 BindingDB Target Chain Sequence 11 PDB ID(s) of Target Chain 11 UniProt (SwissProt) Recommended Name of Target Chain 11 UniProt (SwissProt) Entry Name of Target Chain 11 UniProt (SwissProt) Primary ID of Target Chain 11 UniProt (SwissProt) Secondary ID(s) of Target Chain 11 UniProt (SwissProt) Alternative ID(s) of Target Chain 11 UniProt (TrEMBL) Submitted Name of Target Chain 11 UniProt (TrEMBL) Entry Name of Target Chain 11 UniProt (TrEMBL) Primary ID of Target Chain 11 UniProt (TrEMBL) Secondary ID(s) of Target Chain 11 UniProt (TrEMBL) Alternative ID(s) of Target Chain 11 BindingDB Target Chain Sequence 12 PDB ID(s) of Target Chain 12 UniProt (SwissProt) Recommended Name of Target Chain 12 UniProt (SwissProt) Entry Name of Target Chain 12 UniProt (SwissProt) Primary ID of Target Chain 12 UniProt (SwissProt) Secondary ID(s) of Target Chain 12 UniProt (SwissProt) Alternative ID(s) of Target Chain 12 UniProt (TrEMBL) Submitted Name of Target Chain 12 UniProt (TrEMBL) Entry Name of Target Chain 12 UniProt (TrEMBL) Primary ID of Target Chain 12 UniProt (TrEMBL) Secondary ID(s) of Target Chain 12 UniProt (TrEMBL) Alternative ID(s) of Target Chain 12 BindingDB Target Chain Sequence 13 PDB ID(s) of Target Chain 13 UniProt (SwissProt) Recommended Name of Target Chain 13 UniProt (SwissProt) Entry Name of Target Chain 13 UniProt (SwissProt) Primary ID of Target Chain 13 UniProt (SwissProt) Secondary ID(s) of Target Chain 13 UniProt (SwissProt) Alternative ID(s) of Target Chain 13 UniProt (TrEMBL) Submitted Name of Target Chain 13 UniProt (TrEMBL) Entry Name of Target Chain 13 UniProt (TrEMBL) Primary ID of Target Chain 13 UniProt (TrEMBL) Secondary ID(s) of Target Chain 13 UniProt (TrEMBL) Alternative ID(s) of Target Chain 13 BindingDB Target Chain Sequence 14 PDB ID(s) of Target Chain 14 UniProt (SwissProt) Recommended Name of Target Chain 14 UniProt (SwissProt) Entry Name of Target Chain 14 UniProt (SwissProt) Primary ID of Target Chain 14 UniProt (SwissProt) Secondary ID(s) of Target Chain 14 UniProt (SwissProt) Alternative ID(s) of Target Chain 14 UniProt (TrEMBL) Submitted Name of Target Chain 14 UniProt (TrEMBL) Entry Name of Target Chain 14 UniProt (TrEMBL) Primary ID of Target Chain 14 UniProt (TrEMBL) Secondary ID(s) of Target Chain 14 UniProt (TrEMBL) Alternative ID(s) of Target Chain 14 BindingDB Target Chain Sequence 15 PDB ID(s) of Target Chain 15 UniProt (SwissProt) Recommended Name of Target Chain 15 UniProt (SwissProt) Entry Name of Target Chain 15 UniProt (SwissProt) Primary ID of Target Chain 15 UniProt (SwissProt) Secondary ID(s) of Target Chain 15 UniProt (SwissProt) Alternative ID(s) of Target Chain 15 UniProt (TrEMBL) Submitted Name of Target Chain 15 UniProt (TrEMBL) Entry Name of Target Chain 15 UniProt (TrEMBL) Primary ID of Target Chain 15 UniProt (TrEMBL) Secondary ID(s) of Target Chain 15 UniProt (TrEMBL) Alternative ID(s) of Target Chain 15 BindingDB Target Chain Sequence 16 PDB ID(s) of Target Chain 16 UniProt (SwissProt) Recommended Name of Target Chain 16 UniProt (SwissProt) Entry Name of Target Chain 16 UniProt (SwissProt) Primary ID of Target Chain 16 UniProt (SwissProt) Secondary ID(s) of Target Chain 16 UniProt (SwissProt) Alternative ID(s) of Target Chain 16 UniProt (TrEMBL) Submitted Name of Target Chain 16 UniProt (TrEMBL) Entry Name of Target Chain 16 UniProt (TrEMBL) Primary ID of Target Chain 16 UniProt (TrEMBL) Secondary ID(s) of Target Chain 16 UniProt (TrEMBL) Alternative ID(s) of Target Chain 16 BindingDB Target Chain Sequence 17 PDB ID(s) of Target Chain 17 UniProt (SwissProt) Recommended Name of Target Chain 17 UniProt (SwissProt) Entry Name of Target Chain 17 UniProt (SwissProt) Primary ID of Target Chain 17 UniProt (SwissProt) Secondary ID(s) of Target Chain 17 UniProt (SwissProt) Alternative ID(s) of Target Chain 17 UniProt (TrEMBL) Submitted Name of Target Chain 17 UniProt (TrEMBL) Entry Name of Target Chain 17 UniProt (TrEMBL) Primary ID of Target Chain 17 UniProt (TrEMBL) Secondary ID(s) of Target Chain 17 UniProt (TrEMBL) Alternative ID(s) of Target Chain 17 BindingDB Target Chain Sequence 18 PDB ID(s) of Target Chain 18 UniProt (SwissProt) Recommended Name of Target Chain 18 UniProt (SwissProt) Entry Name of Target Chain 18 UniProt (SwissProt) Primary ID of Target Chain 18 UniProt (SwissProt) Secondary ID(s) of Target Chain 18 UniProt (SwissProt) Alternative ID(s) of Target Chain 18 UniProt (TrEMBL) Submitted Name of Target Chain 18 UniProt (TrEMBL) Entry Name of Target Chain 18 UniProt (TrEMBL) Primary ID of Target Chain 18 UniProt (TrEMBL) Secondary ID(s) of Target Chain 18 UniProt (TrEMBL) Alternative ID(s) of Target Chain 18 BindingDB Target Chain Sequence 19 PDB ID(s) of Target Chain 19 UniProt (SwissProt) Recommended Name of Target Chain 19 UniProt (SwissProt) Entry Name of Target Chain 19 UniProt (SwissProt) Primary ID of Target Chain 19 UniProt (SwissProt) Secondary ID(s) of Target Chain 19 UniProt (SwissProt) Alternative ID(s) of Target Chain 19 UniProt (TrEMBL) Submitted Name of Target Chain 19 UniProt (TrEMBL) Entry Name of Target Chain 19 UniProt (TrEMBL) Primary ID of Target Chain 19 UniProt (TrEMBL) Secondary ID(s) of Target Chain 19 UniProt (TrEMBL) Alternative ID(s) of Target Chain 19 BindingDB Target Chain Sequence 20 PDB ID(s) of Target Chain 20 UniProt (SwissProt) Recommended Name of Target Chain 20 UniProt (SwissProt) Entry Name of Target Chain 20 UniProt (SwissProt) Primary ID of Target Chain 20 UniProt (SwissProt) Secondary ID(s) of Target Chain 20 UniProt (SwissProt) Alternative ID(s) of Target Chain 20 UniProt (TrEMBL) Submitted Name of Target Chain 20 UniProt (TrEMBL) Entry Name of Target Chain 20 UniProt (TrEMBL) Primary ID of Target Chain 20 UniProt (TrEMBL) Secondary ID(s) of Target Chain 20 UniProt (TrEMBL) Alternative ID(s) of Target Chain 20 BindingDB Target Chain Sequence 21 PDB ID(s) of Target Chain 21 UniProt (SwissProt) Recommended Name of Target Chain 21 UniProt (SwissProt) Entry Name of Target Chain 21 UniProt (SwissProt) Primary ID of Target Chain 21 UniProt (SwissProt) Secondary ID(s) of Target Chain 21 UniProt (SwissProt) Alternative ID(s) of Target Chain 21 UniProt (TrEMBL) Submitted Name of Target Chain 21 UniProt (TrEMBL) Entry Name of Target Chain 21 UniProt (TrEMBL) Primary ID of Target Chain 21 UniProt (TrEMBL) Secondary ID(s) of Target Chain 21 UniProt (TrEMBL) Alternative ID(s) of Target Chain 21 BindingDB Target Chain Sequence 22 PDB ID(s) of Target Chain 22 UniProt (SwissProt) Recommended Name of Target Chain 22 UniProt (SwissProt) Entry Name of Target Chain 22 UniProt (SwissProt) Primary ID of Target Chain 22 UniProt (SwissProt) Secondary ID(s) of Target Chain 22 UniProt (SwissProt) Alternative ID(s) of Target Chain 22 UniProt (TrEMBL) Submitted Name of Target Chain 22 UniProt (TrEMBL) Entry Name of Target Chain 22 UniProt (TrEMBL) Primary ID of Target Chain 22 UniProt (TrEMBL) Secondary ID(s) of Target Chain 22 UniProt (TrEMBL) Alternative ID(s) of Target Chain 22 BindingDB Target Chain Sequence 23 PDB ID(s) of Target Chain 23 UniProt (SwissProt) Recommended Name of Target Chain 23 UniProt (SwissProt) Entry Name of Target Chain 23 UniProt (SwissProt) Primary ID of Target Chain 23 UniProt (SwissProt) Secondary ID(s) of Target Chain 23 UniProt (SwissProt) Alternative ID(s) of Target Chain 23 UniProt (TrEMBL) Submitted Name of Target Chain 23 UniProt (TrEMBL) Entry Name of Target Chain 23 UniProt (TrEMBL) Primary ID of Target Chain 23 UniProt (TrEMBL) Secondary ID(s) of Target Chain 23 UniProt (TrEMBL) Alternative ID(s) of Target Chain 23 BindingDB Target Chain Sequence 24 PDB ID(s) of Target Chain 24 UniProt (SwissProt) Recommended Name of Target Chain 24 UniProt (SwissProt) Entry Name of Target Chain 24 UniProt (SwissProt) Primary ID of Target Chain 24 UniProt (SwissProt) Secondary ID(s) of Target Chain 24 UniProt (SwissProt) Alternative ID(s) of Target Chain 24 UniProt (TrEMBL) Submitted Name of Target Chain 24 UniProt (TrEMBL) Entry Name of Target Chain 24 UniProt (TrEMBL) Primary ID of Target Chain 24 UniProt (TrEMBL) Secondary ID(s) of Target Chain 24 UniProt (TrEMBL) Alternative ID(s) of Target Chain 24 BindingDB Target Chain Sequence 25 PDB ID(s) of Target Chain 25 UniProt (SwissProt) Recommended Name of Target Chain 25 UniProt (SwissProt) Entry Name of Target Chain 25 UniProt (SwissProt) Primary ID of Target Chain 25 UniProt (SwissProt) Secondary ID(s) of Target Chain 25 UniProt (SwissProt) Alternative ID(s) of Target Chain 25 UniProt (TrEMBL) Submitted Name of Target Chain 25 UniProt (TrEMBL) Entry Name of Target Chain 25 UniProt (TrEMBL) Primary ID of Target Chain 25 UniProt (TrEMBL) Secondary ID(s) of Target Chain 25 UniProt (TrEMBL) Alternative ID(s) of Target Chain 25 BindingDB Target Chain Sequence 26 PDB ID(s) of Target Chain 26 UniProt (SwissProt) Recommended Name of Target Chain 26 UniProt (SwissProt) Entry Name of Target Chain 26 UniProt (SwissProt) Primary ID of Target Chain 26 UniProt (SwissProt) Secondary ID(s) of Target Chain 26 UniProt (SwissProt) Alternative ID(s) of Target Chain 26 UniProt (TrEMBL) Submitted Name of Target Chain 26 UniProt (TrEMBL) Entry Name of Target Chain 26 UniProt (TrEMBL) Primary ID of Target Chain 26 UniProt (TrEMBL) Secondary ID(s) of Target Chain 26 UniProt (TrEMBL) Alternative ID(s) of Target Chain 26 BindingDB Target Chain Sequence 27 PDB ID(s) of Target Chain 27 UniProt (SwissProt) Recommended Name of Target Chain 27 UniProt (SwissProt) Entry Name of Target Chain 27 UniProt (SwissProt) Primary ID of Target Chain 27 UniProt (SwissProt) Secondary ID(s) of Target Chain 27 UniProt (SwissProt) Alternative ID(s) of Target Chain 27 UniProt (TrEMBL) Submitted Name of Target Chain 27 UniProt (TrEMBL) Entry Name of Target Chain 27 UniProt (TrEMBL) Primary ID of Target Chain 27 UniProt (TrEMBL) Secondary ID(s) of Target Chain 27 UniProt (TrEMBL) Alternative ID(s) of Target Chain 27 BindingDB Target Chain Sequence 28 PDB ID(s) of Target Chain 28 UniProt (SwissProt) Recommended Name of Target Chain 28 UniProt (SwissProt) Entry Name of Target Chain 28 UniProt (SwissProt) Primary ID of Target Chain 28 UniProt (SwissProt) Secondary ID(s) of Target Chain 28 UniProt (SwissProt) Alternative ID(s) of Target Chain 28 UniProt (TrEMBL) Submitted Name of Target Chain 28 UniProt (TrEMBL) Entry Name of Target Chain 28 UniProt (TrEMBL) Primary ID of Target Chain 28 UniProt (TrEMBL) Secondary ID(s) of Target Chain 28 UniProt (TrEMBL) Alternative ID(s) of Target Chain 28 BindingDB Target Chain Sequence 29 PDB ID(s) of Target Chain 29 UniProt (SwissProt) Recommended Name of Target Chain 29 UniProt (SwissProt) Entry Name of Target Chain 29 UniProt (SwissProt) Primary ID of Target Chain 29 UniProt (SwissProt) Secondary ID(s) of Target Chain 29 UniProt (SwissProt) Alternative ID(s) of Target Chain 29 UniProt (TrEMBL) Submitted Name of Target Chain 29 UniProt (TrEMBL) Entry Name of Target Chain 29 UniProt (TrEMBL) Primary ID of Target Chain 29 UniProt (TrEMBL) Secondary ID(s) of Target Chain 29 UniProt (TrEMBL) Alternative ID(s) of Target Chain 29 BindingDB Target Chain Sequence 30 PDB ID(s) of Target Chain 30 UniProt (SwissProt) Recommended Name of Target Chain 30 UniProt (SwissProt) Entry Name of Target Chain 30 UniProt (SwissProt) Primary ID of Target Chain 30 UniProt (SwissProt) Secondary ID(s) of Target Chain 30 UniProt (SwissProt) Alternative ID(s) of Target Chain 30 UniProt (TrEMBL) Submitted Name of Target Chain 30 UniProt (TrEMBL) Entry Name of Target Chain 30 UniProt (TrEMBL) Primary ID of Target Chain 30 UniProt (TrEMBL) Secondary ID(s) of Target Chain 30 UniProt (TrEMBL) Alternative ID(s) of Target Chain 30 BindingDB Target Chain Sequence 31 PDB ID(s) of Target Chain 31 UniProt (SwissProt) Recommended Name of Target Chain 31 UniProt (SwissProt) Entry Name of Target Chain 31 UniProt (SwissProt) Primary ID of Target Chain 31 UniProt (SwissProt) Secondary ID(s) of Target Chain 31 UniProt (SwissProt) Alternative ID(s) of Target Chain 31 UniProt (TrEMBL) Submitted Name of Target Chain 31 UniProt (TrEMBL) Entry Name of Target Chain 31 UniProt (TrEMBL) Primary ID of Target Chain 31 UniProt (TrEMBL) Secondary ID(s) of Target Chain 31 UniProt (TrEMBL) Alternative ID(s) of Target Chain 31 BindingDB Target Chain Sequence 32 PDB ID(s) of Target Chain 32 UniProt (SwissProt) Recommended Name of Target Chain 32 UniProt (SwissProt) Entry Name of Target Chain 32 UniProt (SwissProt) Primary ID of Target Chain 32 UniProt (SwissProt) Secondary ID(s) of Target Chain 32 UniProt (SwissProt) Alternative ID(s) of Target Chain 32 UniProt (TrEMBL) Submitted Name of Target Chain 32 UniProt (TrEMBL) Entry Name of Target Chain 32 UniProt (TrEMBL) Primary ID of Target Chain 32 UniProt (TrEMBL) Secondary ID(s) of Target Chain 32 UniProt (TrEMBL) Alternative ID(s) of Target Chain 32 BindingDB Target Chain Sequence 33 PDB ID(s) of Target Chain 33 UniProt (SwissProt) Recommended Name of Target Chain 33 UniProt (SwissProt) Entry Name of Target Chain 33 UniProt (SwissProt) Primary ID of Target Chain 33 UniProt (SwissProt) Secondary ID(s) of Target Chain 33 UniProt (SwissProt) Alternative ID(s) of Target Chain 33 UniProt (TrEMBL) Submitted Name of Target Chain 33 UniProt (TrEMBL) Entry Name of Target Chain 33 UniProt (TrEMBL) Primary ID of Target Chain 33 UniProt (TrEMBL) Secondary ID(s) of Target Chain 33 UniProt (TrEMBL) Alternative ID(s) of Target Chain 33 BindingDB Target Chain Sequence 34 PDB ID(s) of Target Chain 34 UniProt (SwissProt) Recommended Name of Target Chain 34 UniProt (SwissProt) Entry Name of Target Chain 34 UniProt (SwissProt) Primary ID of Target Chain 34 UniProt (SwissProt) Secondary ID(s) of Target Chain 34 UniProt (SwissProt) Alternative ID(s) of Target Chain 34 UniProt (TrEMBL) Submitted Name of Target Chain 34 UniProt (TrEMBL) Entry Name of Target Chain 34 UniProt (TrEMBL) Primary ID of Target Chain 34 UniProt (TrEMBL) Secondary ID(s) of Target Chain 34 UniProt (TrEMBL) Alternative ID(s) of Target Chain 34 BindingDB Target Chain Sequence 35 PDB ID(s) of Target Chain 35 UniProt (SwissProt) Recommended Name of Target Chain 35 UniProt (SwissProt) Entry Name of Target Chain 35 UniProt (SwissProt) Primary ID of Target Chain 35 UniProt (SwissProt) Secondary ID(s) of Target Chain 35 UniProt (SwissProt) Alternative ID(s) of Target Chain 35 UniProt (TrEMBL) Submitted Name of Target Chain 35 UniProt (TrEMBL) Entry Name of Target Chain 35 UniProt (TrEMBL) Primary ID of Target Chain 35 UniProt (TrEMBL) Secondary ID(s) of Target Chain 35 UniProt (TrEMBL) Alternative ID(s) of Target Chain 35 BindingDB Target Chain Sequence 36 PDB ID(s) of Target Chain 36 UniProt (SwissProt) Recommended Name of Target Chain 36 UniProt (SwissProt) Entry Name of Target Chain 36 UniProt (SwissProt) Primary ID of Target Chain 36 UniProt (SwissProt) Secondary ID(s) of Target Chain 36 UniProt (SwissProt) Alternative ID(s) of Target Chain 36 UniProt (TrEMBL) Submitted Name of Target Chain 36 UniProt (TrEMBL) Entry Name of Target Chain 36 UniProt (TrEMBL) Primary ID of Target Chain 36 UniProt (TrEMBL) Secondary ID(s) of Target Chain 36 UniProt (TrEMBL) Alternative ID(s) of Target Chain 36 BindingDB Target Chain Sequence 37 PDB ID(s) of Target Chain 37 UniProt (SwissProt) Recommended Name of Target Chain 37 UniProt (SwissProt) Entry Name of Target Chain 37 UniProt (SwissProt) Primary ID of Target Chain 37 UniProt (SwissProt) Secondary ID(s) of Target Chain 37 UniProt (SwissProt) Alternative ID(s) of Target Chain 37 UniProt (TrEMBL) Submitted Name of Target Chain 37 UniProt (TrEMBL) Entry Name of Target Chain 37 UniProt (TrEMBL) Primary ID of Target Chain 37 UniProt (TrEMBL) Secondary ID(s) of Target Chain 37 UniProt (TrEMBL) Alternative ID(s) of Target Chain 37 BindingDB Target Chain Sequence 38 PDB ID(s) of Target Chain 38 UniProt (SwissProt) Recommended Name of Target Chain 38 UniProt (SwissProt) Entry Name of Target Chain 38 UniProt (SwissProt) Primary ID of Target Chain 38 UniProt (SwissProt) Secondary ID(s) of Target Chain 38 UniProt (SwissProt) Alternative ID(s) of Target Chain 38 UniProt (TrEMBL) Submitted Name of Target Chain 38 UniProt (TrEMBL) Entry Name of Target Chain 38 UniProt (TrEMBL) Primary ID of Target Chain 38 UniProt (TrEMBL) Secondary ID(s) of Target Chain 38 UniProt (TrEMBL) Alternative ID(s) of Target Chain 38 BindingDB Target Chain Sequence 39 PDB ID(s) of Target Chain 39 UniProt (SwissProt) Recommended Name of Target Chain 39 UniProt (SwissProt) Entry Name of Target Chain 39 UniProt (SwissProt) Primary ID of Target Chain 39 UniProt (SwissProt) Secondary ID(s) of Target Chain 39 UniProt (SwissProt) Alternative ID(s) of Target Chain 39 UniProt (TrEMBL) Submitted Name of Target Chain 39 UniProt (TrEMBL) Entry Name of Target Chain 39 UniProt (TrEMBL) Primary ID of Target Chain 39 UniProt (TrEMBL) Secondary ID(s) of Target Chain 39 UniProt (TrEMBL) Alternative ID(s) of Target Chain 39 BindingDB Target Chain Sequence 40 PDB ID(s) of Target Chain 40 UniProt (SwissProt) Recommended Name of Target Chain 40 UniProt (SwissProt) Entry Name of Target Chain 40 UniProt (SwissProt) Primary ID of Target Chain 40 UniProt (SwissProt) Secondary ID(s) of Target Chain 40 UniProt (SwissProt) Alternative ID(s) of Target Chain 40 UniProt (TrEMBL) Submitted Name of Target Chain 40 UniProt (TrEMBL) Entry Name of Target Chain 40 UniProt (TrEMBL) Primary ID of Target Chain 40 UniProt (TrEMBL) Secondary ID(s) of Target Chain 40 UniProt (TrEMBL) Alternative ID(s) of Target Chain 40 BindingDB Target Chain Sequence 41 PDB ID(s) of Target Chain 41 UniProt (SwissProt) Recommended Name of Target Chain 41 UniProt (SwissProt) Entry Name of Target Chain 41 UniProt (SwissProt) Primary ID of Target Chain 41 UniProt (SwissProt) Secondary ID(s) of Target Chain 41 UniProt (SwissProt) Alternative ID(s) of Target Chain 41 UniProt (TrEMBL) Submitted Name of Target Chain 41 UniProt (TrEMBL) Entry Name of Target Chain 41 UniProt (TrEMBL) Primary ID of Target Chain 41 UniProt (TrEMBL) Secondary ID(s) of Target Chain 41 UniProt (TrEMBL) Alternative ID(s) of Target Chain 41 BindingDB Target Chain Sequence 42 PDB ID(s) of Target Chain 42 UniProt (SwissProt) Recommended Name of Target Chain 42 UniProt (SwissProt) Entry Name of Target Chain 42 UniProt (SwissProt) Primary ID of Target Chain 42 UniProt (SwissProt) Secondary ID(s) of Target Chain 42 UniProt (SwissProt) Alternative ID(s) of Target Chain 42 UniProt (TrEMBL) Submitted Name of Target Chain 42 UniProt (TrEMBL) Entry Name of Target Chain 42 UniProt (TrEMBL) Primary ID of Target Chain 42 UniProt (TrEMBL) Secondary ID(s) of Target Chain 42 UniProt (TrEMBL) Alternative ID(s) of Target Chain 42 BindingDB Target Chain Sequence 43 PDB ID(s) of Target Chain 43 UniProt (SwissProt) Recommended Name of Target Chain 43 UniProt (SwissProt) Entry Name of Target Chain 43 UniProt (SwissProt) Primary ID of Target Chain 43 UniProt (SwissProt) Secondary ID(s) of Target Chain 43 UniProt (SwissProt) Alternative ID(s) of Target Chain 43 UniProt (TrEMBL) Submitted Name of Target Chain 43 UniProt (TrEMBL) Entry Name of Target Chain 43 UniProt (TrEMBL) Primary ID of Target Chain 43 UniProt (TrEMBL) Secondary ID(s) of Target Chain 43 UniProt (TrEMBL) Alternative ID(s) of Target Chain 43 BindingDB Target Chain Sequence 44 PDB ID(s) of Target Chain 44 UniProt (SwissProt) Recommended Name of Target Chain 44 UniProt (SwissProt) Entry Name of Target Chain 44 UniProt (SwissProt) Primary ID of Target Chain 44 UniProt (SwissProt) Secondary ID(s) of Target Chain 44 UniProt (SwissProt) Alternative ID(s) of Target Chain 44 UniProt (TrEMBL) Submitted Name of Target Chain 44 UniProt (TrEMBL) Entry Name of Target Chain 44 UniProt (TrEMBL) Primary ID of Target Chain 44 UniProt (TrEMBL) Secondary ID(s) of Target Chain 44 UniProt (TrEMBL) Alternative ID(s) of Target Chain 44 BindingDB Target Chain Sequence 45 PDB ID(s) of Target Chain 45 UniProt (SwissProt) Recommended Name of Target Chain 45 UniProt (SwissProt) Entry Name of Target Chain 45 UniProt (SwissProt) Primary ID of Target Chain 45 UniProt (SwissProt) Secondary ID(s) of Target Chain 45 UniProt (SwissProt) Alternative ID(s) of Target Chain 45 UniProt (TrEMBL) Submitted Name of Target Chain 45 UniProt (TrEMBL) Entry Name of Target Chain 45 UniProt (TrEMBL) Primary ID of Target Chain 45 UniProt (TrEMBL) Secondary ID(s) of Target Chain 45 UniProt (TrEMBL) Alternative ID(s) of Target Chain 45 BindingDB Target Chain Sequence 46 PDB ID(s) of Target Chain 46 UniProt (SwissProt) Recommended Name of Target Chain 46 UniProt (SwissProt) Entry Name of Target Chain 46 UniProt (SwissProt) Primary ID of Target Chain 46 UniProt (SwissProt) Secondary ID(s) of Target Chain 46 UniProt (SwissProt) Alternative ID(s) of Target Chain 46 UniProt (TrEMBL) Submitted Name of Target Chain 46 UniProt (TrEMBL) Entry Name of Target Chain 46 UniProt (TrEMBL) Primary ID of Target Chain 46 UniProt (TrEMBL) Secondary ID(s) of Target Chain 46 UniProt (TrEMBL) Alternative ID(s) of Target Chain 46 BindingDB Target Chain Sequence 47 PDB ID(s) of Target Chain 47 UniProt (SwissProt) Recommended Name of Target Chain 47 UniProt (SwissProt) Entry Name of Target Chain 47 UniProt (SwissProt) Primary ID of Target Chain 47 UniProt (SwissProt) Secondary ID(s) of Target Chain 47 UniProt (SwissProt) Alternative ID(s) of Target Chain 47 UniProt (TrEMBL) Submitted Name of Target Chain 47 UniProt (TrEMBL) Entry Name of Target Chain 47 UniProt (TrEMBL) Primary ID of Target Chain 47 UniProt (TrEMBL) Secondary ID(s) of Target Chain 47 UniProt (TrEMBL) Alternative ID(s) of Target Chain 47 BindingDB Target Chain Sequence 48 PDB ID(s) of Target Chain 48 UniProt (SwissProt) Recommended Name of Target Chain 48 UniProt (SwissProt) Entry Name of Target Chain 48 UniProt (SwissProt) Primary ID of Target Chain 48 UniProt (SwissProt) Secondary ID(s) of Target Chain 48 UniProt (SwissProt) Alternative ID(s) of Target Chain 48 UniProt (TrEMBL) Submitted Name of Target Chain 48 UniProt (TrEMBL) Entry Name of Target Chain 48 UniProt (TrEMBL) Primary ID of Target Chain 48 UniProt (TrEMBL) Secondary ID(s) of Target Chain 48 UniProt (TrEMBL) Alternative ID(s) of Target Chain 48 BindingDB Target Chain Sequence 49 PDB ID(s) of Target Chain 49 UniProt (SwissProt) Recommended Name of Target Chain 49 UniProt (SwissProt) Entry Name of Target Chain 49 UniProt (SwissProt) Primary ID of Target Chain 49 UniProt (SwissProt) Secondary ID(s) of Target Chain 49 UniProt (SwissProt) Alternative ID(s) of Target Chain 49 UniProt (TrEMBL) Submitted Name of Target Chain 49 UniProt (TrEMBL) Entry Name of Target Chain 49 UniProt (TrEMBL) Primary ID of Target Chain 49 UniProt (TrEMBL) Secondary ID(s) of Target Chain 49 UniProt (TrEMBL) Alternative ID(s) of Target Chain 49 BindingDB Target Chain Sequence 50 PDB ID(s) of Target Chain 50 UniProt (SwissProt) Recommended Name of Target Chain 50 UniProt (SwissProt) Entry Name of Target Chain 50 UniProt (SwissProt) Primary ID of Target Chain 50 UniProt (SwissProt) Secondary ID(s) of Target Chain 50 UniProt (SwissProt) Alternative ID(s) of Target Chain 50 UniProt (TrEMBL) Submitted Name of Target Chain 50 UniProt (TrEMBL) Entry Name of Target Chain 50 UniProt (TrEMBL) Primary ID of Target Chain 50 UniProt (TrEMBL) Secondary ID(s) of Target Chain 50 UniProt (TrEMBL) Alternative ID(s) of Target Chain 50 736121 Cc1nnc2sc3c(NCc4ccc(cc4)C(C)(C)O)ncnc3c2c1C InChI=1S/C20H21N5OS/c1-11-12(2)24-25-19-15(11)16-17(27-19)18(23-10-22-16)21-9-13-5-7-14(8-6-13)20(3,4)26/h5-8,10,26H,9H2,1-4H3,(H,21,22,23) ZWNZWHFKGJDMCH-UHFFFAOYSA-N 372260 2-[4-[[(3,4-Dimethylpyrimido[4',5':4,5]thieno[2,3-c]pyridazin-8-yl)amino]methyl]phenyl]propan-2-ol ::US10239887, Cpd. No. 76 Muscarinic acetylcholine receptor M4 Human 52.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372260&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254659 402359201 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736122 Cc1nnc2sc3c(NCc4ccc(cc4)C(C)(C)O)ncnc3c2c1C InChI=1S/C20H21N5OS/c1-11-12(2)24-25-19-15(11)16-17(27-19)18(23-10-22-16)21-9-13-5-7-14(8-6-13)20(3,4)26/h5-8,10,26H,9H2,1-4H3,(H,21,22,23) ZWNZWHFKGJDMCH-UHFFFAOYSA-N 372260 2-[4-[[(3,4-Dimethylpyrimido[4',5':4,5]thieno[2,3-c]pyridazin-8-yl)amino]methyl]phenyl]propan-2-ol ::US10239887, Cpd. No. 76 Muscarinic acetylcholine receptor M4 Rattus 23.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372260&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254659 402359201 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736123 CN(C)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C12H13N5S/c1-6-7(2)15-16-12-8(6)9-10(18-12)11(17(3)4)14-5-13-9/h5H,1-4H3 ABDFEPIADOKELH-UHFFFAOYSA-N 372261 N,N,3,4-tetramethylpyrimido[4',5':4,5]thieno[2,3-c]pyridazin-8-amine ::US10239887, Cpd. No. 1 Muscarinic acetylcholine receptor M4 Human 638 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372261&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254989 402359202 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736124 CN(C)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C12H13N5S/c1-6-7(2)15-16-12-8(6)9-10(18-12)11(17(3)4)14-5-13-9/h5H,1-4H3 ABDFEPIADOKELH-UHFFFAOYSA-N 372261 N,N,3,4-tetramethylpyrimido[4',5':4,5]thieno[2,3-c]pyridazin-8-amine ::US10239887, Cpd. No. 1 Muscarinic acetylcholine receptor M4 Rattus 724 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372261&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254989 402359202 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736125 Cc1nnc2sc3c(NC4CCCCC4)ncnc3c2c1C InChI=1S/C16H19N5S/c1-9-10(2)20-21-16-12(9)13-14(22-16)15(18-8-17-13)19-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H,17,18,19) KIUFLDPLGBOWIP-UHFFFAOYSA-N 372262 N-cyclohexyl-3,4- dimethylpyrimido[4',5':4,5] thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 2 Muscarinic acetylcholine receptor M4 Human 724 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372262&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254612 402359203 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736126 Cc1nnc2sc3c(NC4CCCCC4)ncnc3c2c1C InChI=1S/C16H19N5S/c1-9-10(2)20-21-16-12(9)13-14(22-16)15(18-8-17-13)19-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H,17,18,19) KIUFLDPLGBOWIP-UHFFFAOYSA-N 372262 N-cyclohexyl-3,4- dimethylpyrimido[4',5':4,5] thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 2 Muscarinic acetylcholine receptor M4 Rattus 836 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372262&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254612 402359203 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736127 Cc1nnc2sc3c(NC4CCOCC4)ncnc3c2c1C InChI=1S/C15H17N5OS/c1-8-9(2)19-20-15-11(8)12-13(22-15)14(17-7-16-12)18-10-3-5-21-6-4-10/h7,10H,3-6H2,1-2H3,(H,16,17,18) SRIFPHBXTYUWFX-UHFFFAOYSA-N 372263 3,4-dimethyl-N-(tetrahydro- 2H-pyran-4-yl) pyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 3 Muscarinic acetylcholine receptor M4 Human 446 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372263&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254498 402359204 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736128 Cc1nnc2sc3c(NC4CCOCC4)ncnc3c2c1C InChI=1S/C15H17N5OS/c1-8-9(2)19-20-15-11(8)12-13(22-15)14(17-7-16-12)18-10-3-5-21-6-4-10/h7,10H,3-6H2,1-2H3,(H,16,17,18) SRIFPHBXTYUWFX-UHFFFAOYSA-N 372263 3,4-dimethyl-N-(tetrahydro- 2H-pyran-4-yl) pyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 3 Muscarinic acetylcholine receptor M4 Rattus 521 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372263&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254498 402359204 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736129 Cc1nnc2sc3c(ncnc3c2c1C)N1CCCCC1 InChI=1S/C15H17N5S/c1-9-10(2)18-19-15-11(9)12-13(21-15)14(17-8-16-12)20-6-4-3-5-7-20/h8H,3-7H2,1-2H3 UCXHZENZTYTQPF-UHFFFAOYSA-N 372264 3,4-dimethyl-8-(piperidin-1- yl)pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 4 Muscarinic acetylcholine receptor M4 Human 120 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372264&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254815 402359205 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736130 Cc1nnc2sc3c(ncnc3c2c1C)N1CCCCC1 InChI=1S/C15H17N5S/c1-9-10(2)18-19-15-11(9)12-13(21-15)14(17-8-16-12)20-6-4-3-5-7-20/h8H,3-7H2,1-2H3 UCXHZENZTYTQPF-UHFFFAOYSA-N 372264 3,4-dimethyl-8-(piperidin-1- yl)pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 4 Muscarinic acetylcholine receptor M4 Rattus 215 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372264&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254815 402359205 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736131 Cc1nnc2sc3c(NC4CCC4)ncnc3c2c1C InChI=1S/C14H15N5S/c1-7-8(2)18-19-14-10(7)11-12(20-14)13(16-6-15-11)17-9-4-3-5-9/h6,9H,3-5H2,1-2H3,(H,15,16,17) SDKQUMSJHGKJIJ-UHFFFAOYSA-N 372265 N-cyclobutyl-3,4- dimethylpyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 5 Muscarinic acetylcholine receptor M4 Human 83.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372265 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372265&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254931 402359206 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736132 Cc1nnc2sc3c(NC4CCC4)ncnc3c2c1C InChI=1S/C14H15N5S/c1-7-8(2)18-19-14-10(7)11-12(20-14)13(16-6-15-11)17-9-4-3-5-9/h6,9H,3-5H2,1-2H3,(H,15,16,17) SDKQUMSJHGKJIJ-UHFFFAOYSA-N 372265 N-cyclobutyl-3,4- dimethylpyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 5 Muscarinic acetylcholine receptor M4 Rattus 112 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372265 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372265&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254931 402359206 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736133 Cc1nnc2sc3c(ncnc3c2c1C)N1CCCC1 InChI=1S/C14H15N5S/c1-8-9(2)17-18-14-10(8)11-12(20-14)13(16-7-15-11)19-5-3-4-6-19/h7H,3-6H2,1-2H3 JOSRFBUFMOEIRY-UHFFFAOYSA-N 372266 3,4-dimethyl-8-(pyrrolidin-1- yl)pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 6 Muscarinic acetylcholine receptor M4 Human 48.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372266 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372266&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255048 402359207 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736134 Cc1nnc2sc3c(ncnc3c2c1C)N1CCCC1 InChI=1S/C14H15N5S/c1-8-9(2)17-18-14-10(8)11-12(20-14)13(16-7-15-11)19-5-3-4-6-19/h7H,3-6H2,1-2H3 JOSRFBUFMOEIRY-UHFFFAOYSA-N 372266 3,4-dimethyl-8-(pyrrolidin-1- yl)pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 6 Muscarinic acetylcholine receptor M4 Rattus 75.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372266 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372266&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255048 402359207 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736135 Cc1nnc2sc3c(NC4CN(C4)c4ncc(cn4)C(F)(F)F)ncnc3c2c1C InChI=1S/C18H15F3N8S/c1-8-9(2)27-28-16-12(8)13-14(30-16)15(25-7-24-13)26-11-5-29(6-11)17-22-3-10(4-23-17)18(19,20)21/h3-4,7,11H,5-6H2,1-2H3,(H,24,25,26) NGCMHJVOEXCXKY-UHFFFAOYSA-N 372267 3,4-dimethyl-N-(1-(5- (trifluoromethyl) pyrimidin-2-yl)azetidin- 3-yl)pyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 7 Muscarinic acetylcholine receptor M4 Human 251 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372267 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372267&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254706 402359208 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736136 Cc1nnc2sc3c(NC4CN(C4)c4ncc(cn4)C(F)(F)F)ncnc3c2c1C InChI=1S/C18H15F3N8S/c1-8-9(2)27-28-16-12(8)13-14(30-16)15(25-7-24-13)26-11-5-29(6-11)17-22-3-10(4-23-17)18(19,20)21/h3-4,7,11H,5-6H2,1-2H3,(H,24,25,26) NGCMHJVOEXCXKY-UHFFFAOYSA-N 372267 3,4-dimethyl-N-(1-(5- (trifluoromethyl) pyrimidin-2-yl)azetidin- 3-yl)pyrimido[4',5':4,5] thieno[2,3-c]pyridazin-8- amine::US10239887, Cpd. No. 7 Muscarinic acetylcholine receptor M4 Rattus 30.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372267 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372267&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254706 402359208 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736137 Cc1nnc2sc3c(ncnc3c2c1C)N1CCN(CC1)C1CC1 InChI=1S/C17H20N6S/c1-10-11(2)20-21-17-13(10)14-15(24-17)16(19-9-18-14)23-7-5-22(6-8-23)12-3-4-12/h9,12H,3-8H2,1-2H3 RCATWLHHSHDVMC-UHFFFAOYSA-N 372268 8-(4- cyclopropylpiperazin- 1-yl)-3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 8 Muscarinic acetylcholine receptor M4 Human 616 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372268&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254906 402359209 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736138 Cc1nnc2sc3c(ncnc3c2c1C)N1CCN(CC1)C1CC1 InChI=1S/C17H20N6S/c1-10-11(2)20-21-17-13(10)14-15(24-17)16(19-9-18-14)23-7-5-22(6-8-23)12-3-4-12/h9,12H,3-8H2,1-2H3 RCATWLHHSHDVMC-UHFFFAOYSA-N 372268 8-(4- cyclopropylpiperazin- 1-yl)-3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 8 Muscarinic acetylcholine receptor M4 Rattus 700 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372268&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254906 402359209 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736139 Cc1nnc2sc3c(ncnc3c2c1C)N1CCC1 InChI=1S/C13H13N5S/c1-7-8(2)16-17-13-9(7)10-11(19-13)12(15-6-14-10)18-4-3-5-18/h6H,3-5H2,1-2H3 QMYVDUQNGSLAIG-UHFFFAOYSA-N 372269 8-(azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 9 Muscarinic acetylcholine receptor M4 Human 351 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372269&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254477 402359210 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736140 Cc1nnc2sc3c(ncnc3c2c1C)N1CCC1 InChI=1S/C13H13N5S/c1-7-8(2)16-17-13-9(7)10-11(19-13)12(15-6-14-10)18-4-3-5-18/h6H,3-5H2,1-2H3 QMYVDUQNGSLAIG-UHFFFAOYSA-N 372269 8-(azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 9 Muscarinic acetylcholine receptor M4 Rattus 405 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372269&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254477 402359210 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736141 Cc1nnc2sc3c(ncnc3c2c1C)N1CC2CC2C1 InChI=1S/C15H15N5S/c1-7-8(2)18-19-15-11(7)12-13(21-15)14(17-6-16-12)20-4-9-3-10(9)5-20/h6,9-10H,3-5H2,1-2H3 LJNYDIGNZVYAHL-UHFFFAOYSA-N 372270 8-(3-azabicyclo[3.1.0] hexan-3-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 10 Muscarinic acetylcholine receptor M4 Human 21.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372270&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254590 402359211 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736142 Cc1nnc2sc3c(ncnc3c2c1C)N1CC2CC2C1 InChI=1S/C15H15N5S/c1-7-8(2)18-19-15-11(7)12-13(21-15)14(17-6-16-12)20-4-9-3-10(9)5-20/h6,9-10H,3-5H2,1-2H3 LJNYDIGNZVYAHL-UHFFFAOYSA-N 372270 8-(3-azabicyclo[3.1.0] hexan-3-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 10 Muscarinic acetylcholine receptor M4 Rattus 36.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372270&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254590 402359211 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736143 CN(C)C1CCN(C1)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C16H20N6S/c1-9-10(2)19-20-16-12(9)13-14(23-16)15(18-8-17-13)22-6-5-11(7-22)21(3)4/h8,11H,5-7H2,1-4H3 UBZIELWNLMLWQD-UHFFFAOYSA-N 372271 1-(3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)-N,N- dimethylpyrrolidin- 3-amine::US10239887, Cpd. No. 11 Muscarinic acetylcholine receptor M4 Human 257 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372271&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254726 402359212 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736144 CN(C)C1CCN(C1)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C16H20N6S/c1-9-10(2)19-20-16-12(9)13-14(23-16)15(18-8-17-13)22-6-5-11(7-22)21(3)4/h8,11H,5-7H2,1-4H3 UBZIELWNLMLWQD-UHFFFAOYSA-N 372271 1-(3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)-N,N- dimethylpyrrolidin- 3-amine::US10239887, Cpd. No. 11 Muscarinic acetylcholine receptor M4 Rattus 326 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372271&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254726 402359212 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736145 COCCN(C)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C14H17N5OS/c1-8-9(2)17-18-14-10(8)11-12(21-14)13(16-7-15-11)19(3)5-6-20-4/h7H,5-6H2,1-4H3 NKZGFTIDSNTJTH-UHFFFAOYSA-N 372272 N-(2-methoxyethyl)- N,3,4-trimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 12 Muscarinic acetylcholine receptor M4 Human 846 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372272&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254903 402359213 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736146 COCCN(C)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C14H17N5OS/c1-8-9(2)17-18-14-10(8)11-12(21-14)13(16-7-15-11)19(3)5-6-20-4/h7H,5-6H2,1-4H3 NKZGFTIDSNTJTH-UHFFFAOYSA-N 372272 N-(2-methoxyethyl)- N,3,4-trimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 12 Muscarinic acetylcholine receptor M4 Rattus 927 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372272&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254903 402359213 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736147 Cc1nnc2sc3c(ncnc3c2c1C)N1CC2(COC2)C1 InChI=1S/C15H15N5OS/c1-8-9(2)18-19-14-10(8)11-12(22-14)13(17-7-16-11)20-3-15(4-20)5-21-6-15/h7H,3-6H2,1-2H3 NGVQCUKQHWFSFL-UHFFFAOYSA-N 372273 6-(3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)-2-oxa-6- azaspiro[3.3]heptane::US10239887, Cpd. No. 13 Muscarinic acetylcholine receptor M4 Human 123 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372273&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255015 402359214 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736148 Cc1nnc2sc3c(ncnc3c2c1C)N1CC2(COC2)C1 InChI=1S/C15H15N5OS/c1-8-9(2)18-19-14-10(8)11-12(22-14)13(17-7-16-11)20-3-15(4-20)5-21-6-15/h7H,3-6H2,1-2H3 NGVQCUKQHWFSFL-UHFFFAOYSA-N 372273 6-(3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)-2-oxa-6- azaspiro[3.3]heptane::US10239887, Cpd. No. 13 Muscarinic acetylcholine receptor M4 Rattus 231 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372273&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255015 402359214 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736149 COCC1CN(C1)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C15H17N5OS/c1-8-9(2)18-19-15-11(8)12-13(22-15)14(17-7-16-12)20-4-10(5-20)6-21-3/h7,10H,4-6H2,1-3H3 YZHFIHYNMHPSEA-UHFFFAOYSA-N 372274 8-(3-(methoxymethyl) azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 14 Muscarinic acetylcholine receptor M4 Human 418 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372274&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254982 402359215 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736150 COCC1CN(C1)c1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C15H17N5OS/c1-8-9(2)18-19-15-11(8)12-13(22-15)14(17-7-16-12)20-4-10(5-20)6-21-3/h7,10H,4-6H2,1-3H3 YZHFIHYNMHPSEA-UHFFFAOYSA-N 372274 8-(3-(methoxymethyl) azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 14 Muscarinic acetylcholine receptor M4 Rattus 883 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372274&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254982 402359215 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736151 Cc1cnc2sc3c(ncnc3c2c1)N1CCCC1 InChI=1S/C14H14N4S/c1-9-6-10-11-12(19-14(10)15-7-9)13(17-8-16-11)18-4-2-3-5-18/h6-8H,2-5H2,1H3 WNVHONNDYZZMQU-UHFFFAOYSA-N 372275 8-methyl-4- (pyrrolidin-1-yl) pyrido[3',2':4,5]thieno [3,2-d]pyrimidine::US10239887, Cpd. No. 15 Muscarinic acetylcholine receptor M4 Human 161 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372275&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254822 402359216 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736152 Cc1cnc2sc3c(ncnc3c2c1)N1CCCC1 InChI=1S/C14H14N4S/c1-9-6-10-11-12(19-14(10)15-7-9)13(17-8-16-11)18-4-2-3-5-18/h6-8H,2-5H2,1H3 WNVHONNDYZZMQU-UHFFFAOYSA-N 372275 8-methyl-4- (pyrrolidin-1-yl) pyrido[3',2':4,5]thieno [3,2-d]pyrimidine::US10239887, Cpd. No. 15 Muscarinic acetylcholine receptor M4 Rattus >10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372275&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254822 402359216 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736153 Cc1cnc2sc3c(ncnc3c2c1)N1CCC(F)(F)C1 InChI=1S/C14H12F2N4S/c1-8-4-9-10-11(21-13(9)17-5-8)12(19-7-18-10)20-3-2-14(15,16)6-20/h4-5,7H,2-3,6H2,1H3 DDJCTUGVGVTRFJ-UHFFFAOYSA-N 372276 4-(3,3-difluoropyrrolidin- 1-yl)-8-methylpyrido [3',2':4,5]thieno[3,2-d] pyrimidine::US10239887, Cpd. No. 16 Muscarinic acetylcholine receptor M4 Human 377 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372276&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254864 402359217 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736154 Cc1cnc2sc3c(ncnc3c2c1)N1CCC(F)(F)C1 InChI=1S/C14H12F2N4S/c1-8-4-9-10-11(21-13(9)17-5-8)12(19-7-18-10)20-3-2-14(15,16)6-20/h4-5,7H,2-3,6H2,1H3 DDJCTUGVGVTRFJ-UHFFFAOYSA-N 372276 4-(3,3-difluoropyrrolidin- 1-yl)-8-methylpyrido [3',2':4,5]thieno[3,2-d] pyrimidine::US10239887, Cpd. No. 16 Muscarinic acetylcholine receptor M4 Rattus >10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372276&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254864 402359217 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736155 Cc1cnc2sc3c(NC4CN(C4)c4ncc(cn4)C(F)(F)F)ncnc3c2c1 InChI=1S/C18H14F3N7S/c1-9-2-12-13-14(29-16(12)22-3-9)15(26-8-25-13)27-11-6-28(7-11)17-23-4-10(5-24-17)18(19,20)21/h2-5,8,11H,6-7H2,1H3,(H,25,26,27) AUNSVCHVURAJLW-UHFFFAOYSA-N 372278 8-methyl-N-(1-(5- (trifluoromethyl) pyrimidin-2-yl)azetidin- 3-yl)pyrido[3',2':4,5] thieno[3,2-d]pyrimidin- 4-amine::US10239887, Cpd. No. 17 Muscarinic acetylcholine receptor M4 Human 674 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372278&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254607 402359219 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736156 Cc1cnc2sc3c(NC4CN(C4)c4ncc(cn4)C(F)(F)F)ncnc3c2c1 InChI=1S/C18H14F3N7S/c1-9-2-12-13-14(29-16(12)22-3-9)15(26-8-25-13)27-11-6-28(7-11)17-23-4-10(5-24-17)18(19,20)21/h2-5,8,11H,6-7H2,1H3,(H,25,26,27) AUNSVCHVURAJLW-UHFFFAOYSA-N 372278 8-methyl-N-(1-(5- (trifluoromethyl) pyrimidin-2-yl)azetidin- 3-yl)pyrido[3',2':4,5] thieno[3,2-d]pyrimidin- 4-amine::US10239887, Cpd. No. 17 Muscarinic acetylcholine receptor M4 Rattus 424 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372278&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254607 402359219 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736157 Cc1cnc2sc3c(ncnc3c2c1)N1CCC1 InChI=1S/C13H12N4S/c1-8-5-9-10-11(18-13(9)14-6-8)12(16-7-15-10)17-3-2-4-17/h5-7H,2-4H2,1H3 VGLAFLSLWYVYEZ-UHFFFAOYSA-N 372279 4-(azetidin-1-yl)-8- methylpyrido[3',2':4,5] thieno[3,2-d]pyrimidine::US10239887, Cpd. No. 18 Muscarinic acetylcholine receptor M4 Human 807 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372279 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372279&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254550 402359220 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736158 Cc1cnc2sc3c(ncnc3c2c1)N1CCC1 InChI=1S/C13H12N4S/c1-8-5-9-10-11(18-13(9)14-6-8)12(16-7-15-10)17-3-2-4-17/h5-7H,2-4H2,1H3 VGLAFLSLWYVYEZ-UHFFFAOYSA-N 372279 4-(azetidin-1-yl)-8- methylpyrido[3',2':4,5] thieno[3,2-d]pyrimidine::US10239887, Cpd. No. 18 Muscarinic acetylcholine receptor M4 Rattus 2500 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372279 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372279&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254550 402359220 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736159 Cc1cnc2sc3c(ncnc3c2c1)N1CC2(COC2)C1 InChI=1S/C15H14N4OS/c1-9-2-10-11-12(21-14(10)16-3-9)13(18-8-17-11)19-4-15(5-19)6-20-7-15/h2-3,8H,4-7H2,1H3 AHNWMSKJPGPESB-UHFFFAOYSA-N 372280 6-(8-methylpyrido [3',2':4,5]thieno[3,2-d] pyrimidin-4-yl)-2-oxa-6- azaspiro[3.3]heptane::US10239887, Cpd. No. 19 Muscarinic acetylcholine receptor M4 Human 456 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372280 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372280&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254489 402359221 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736160 Cc1cnc2sc3c(ncnc3c2c1)N1CC2(COC2)C1 InChI=1S/C15H14N4OS/c1-9-2-10-11-12(21-14(10)16-3-9)13(18-8-17-11)19-4-15(5-19)6-20-7-15/h2-3,8H,4-7H2,1H3 AHNWMSKJPGPESB-UHFFFAOYSA-N 372280 6-(8-methylpyrido [3',2':4,5]thieno[3,2-d] pyrimidin-4-yl)-2-oxa-6- azaspiro[3.3]heptane::US10239887, Cpd. No. 19 Muscarinic acetylcholine receptor M4 Rattus 1150 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372280 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372280&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254489 402359221 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736161 FC(F)(F)c1cnc(nc1)N1CC(C1)Nc1ncnc2c1sc1nccnc21 InChI=1S/C16H11F3N8S/c17-16(18,19)8-3-22-15(23-4-8)27-5-9(6-27)26-13-12-10(24-7-25-13)11-14(28-12)21-2-1-20-11/h1-4,7,9H,5-6H2,(H,24,25,26) CPEOLYRJSWQZIE-UHFFFAOYSA-N 372281 N-(1-(5-(trifluoromethyl) pyrimidin-2-yl)azetidin-3- yl)pyrazino[2',3':4,5] thieno[3,2-d]pyrimidin-4- amine::US10239887, Cpd. No. 20 Muscarinic acetylcholine receptor M4 Human >10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372281&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254853 402359222 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736162 FC(F)(F)c1cnc(nc1)N1CC(C1)Nc1ncnc2c1sc1nccnc21 InChI=1S/C16H11F3N8S/c17-16(18,19)8-3-22-15(23-4-8)27-5-9(6-27)26-13-12-10(24-7-25-13)11-14(28-12)21-2-1-20-11/h1-4,7,9H,5-6H2,(H,24,25,26) CPEOLYRJSWQZIE-UHFFFAOYSA-N 372281 N-(1-(5-(trifluoromethyl) pyrimidin-2-yl)azetidin-3- yl)pyrazino[2',3':4,5] thieno[3,2-d]pyrimidin-4- amine::US10239887, Cpd. No. 20 Muscarinic acetylcholine receptor M4 Rattus 2800 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372281&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254853 402359222 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736163 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(F)(F)C1 InChI=1S/C13H11F2N5S/c1-6-7(2)18-19-12-8(6)9-10(21-12)11(17-5-16-9)20-3-13(14,15)4-20/h5H,3-4H2,1-2H3 BJFURVMZXZEASW-UHFFFAOYSA-N 372282 8-(3,3-difluoroazetidin- 1-yl)-3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 21 Muscarinic acetylcholine receptor M4 Human 426 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372282&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254453 402359223 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736164 Cc1nnc2sc3c(NC4CN(C4)c4ccc(nc4)C(F)(F)F)ncnc3c2c1C InChI=1S/C19H16F3N7S/c1-9-10(2)27-28-18-14(9)15-16(30-18)17(25-8-24-15)26-11-6-29(7-11)12-3-4-13(23-5-12)19(20,21)22/h3-5,8,11H,6-7H2,1-2H3,(H,24,25,26) CZUHGLIOTVBIRJ-UHFFFAOYSA-N 372284 3,4-dimethyl-N-(1-(6- (trifluoromethyl) pyridin-3-yl)azetidin-3-yl) pyrimido[4',5':4,5]thieno [2,3-c]pyridazin-8-amine::US10239887, Cpd. No. 22 Muscarinic acetylcholine receptor M4 Human 10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372284 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372284&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254846 402359225 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736165 Cc1nnc2sc3c(NC4CCN(C4)c4ccccc4)ncnc3c2c1C InChI=1S/C20H20N6S/c1-12-13(2)24-25-20-16(12)17-18(27-20)19(22-11-21-17)23-14-8-9-26(10-14)15-6-4-3-5-7-15/h3-7,11,14H,8-10H2,1-2H3,(H,21,22,23) DOELVVJGAUZNSI-UHFFFAOYSA-N 372285 3,4-dimethyl-N-(1- phenylpyrrolidin-3-yl) pyrimido[4',5':4,5]thieno [2,3-c]pyridazin-8-amine::US10239887, Cpd. No. 23 Muscarinic acetylcholine receptor M4 Human 10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372285&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254800 402359226 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736166 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)c1ccncc1 InChI=1S/C18H16N6S/c1-10-11(2)22-23-18-14(10)15-16(25-18)17(21-9-20-15)24-7-13(8-24)12-3-5-19-6-4-12/h3-6,9,13H,7-8H2,1-2H3 DEDOYHRGLZOXLI-UHFFFAOYSA-N 372286 3,4-dimethyl-8-(3- (pyridin-4-yl)azetidin- 1-yl)pyrimido[4',5':4,5] thieno[2,3-c]pyridazine::US10239887, Cpd. No. 24 Muscarinic acetylcholine receptor M4 Human 64.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372286&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254738 402359227 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736167 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)c1ccncc1 InChI=1S/C18H16N6S/c1-10-11(2)22-23-18-14(10)15-16(25-18)17(21-9-20-15)24-7-13(8-24)12-3-5-19-6-4-12/h3-6,9,13H,7-8H2,1-2H3 DEDOYHRGLZOXLI-UHFFFAOYSA-N 372286 3,4-dimethyl-8-(3- (pyridin-4-yl)azetidin- 1-yl)pyrimido[4',5':4,5] thieno[2,3-c]pyridazine::US10239887, Cpd. No. 24 Muscarinic acetylcholine receptor M4 Rattus 185 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000383&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372286&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254738 402359227 1 MNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR Muscarinic acetylcholine receptor M4 ACM4_RAT P08485 736168 Cc1nnc2sc3c(NC4CC4)ncnc3c2c1C InChI=1S/C13H13N5S/c1-6-7(2)17-18-13-9(6)10-11(19-13)12(15-5-14-10)16-8-3-4-8/h5,8H,3-4H2,1-2H3,(H,14,15,16) GOARUPDNVNVAMN-UHFFFAOYSA-N 372287 N-cyclopropyl- 3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 25 Muscarinic acetylcholine receptor M4 Human 468 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372287&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255043 402359228 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736169 COc1ccc(cc1)C1CC1Nc1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C20H19N5OS/c1-10-11(2)24-25-20-16(10)17-18(27-20)19(22-9-21-17)23-15-8-14(15)12-4-6-13(26-3)7-5-12/h4-7,9,14-15H,8H2,1-3H3,(H,21,22,23) RIJPDMIRRQNWGX-UHFFFAOYSA-N 372288 N-(2-(4-methoxyphenyl) cyclopropyl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 26 Muscarinic acetylcholine receptor M4 Human 10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372288&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254877 402359229 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736170 COc1ccc(CNc2ncnc3c2sc2nnc(C)c(C)c32)cc1F InChI=1S/C18H16FN5OS/c1-9-10(2)23-24-18-14(9)15-16(26-18)17(22-8-21-15)20-7-11-4-5-13(25-3)12(19)6-11/h4-6,8H,7H2,1-3H3,(H,20,21,22) YNPFUSWQWFQSLD-UHFFFAOYSA-N 372289 N-(3-fluoro-4- methoxybenzyl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 27 Muscarinic acetylcholine receptor M4 Human 10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372289&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254886 402359230 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736171 Cc1nnc2sc3c(ncnc3c2c1C)N1CCC(C1)c1ccccc1 InChI=1S/C20H19N5S/c1-12-13(2)23-24-20-16(12)17-18(26-20)19(22-11-21-17)25-9-8-15(10-25)14-6-4-3-5-7-14/h3-7,11,15H,8-10H2,1-2H3 ASNWITYXZOOTGK-UHFFFAOYSA-N 372290 3,4-dimethyl-8-(3- phenylpyrrolidin-1-yl) pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 28 Muscarinic acetylcholine receptor M4 Human 3555 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372290&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254368 402359231 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736172 Cc1nnc2sc3c(NCc4ccc(cc4)-c4cccnc4F)ncnc3c2c1C InChI=1S/C22H17FN6S/c1-12-13(2)28-29-22-17(12)18-19(30-22)21(27-11-26-18)25-10-14-5-7-15(8-6-14)16-4-3-9-24-20(16)23/h3-9,11H,10H2,1-2H3,(H,25,26,27) IDAKPHHDTCRQMK-UHFFFAOYSA-N 372291 N-(4-(2-fluoropyridin- 3-yl)benzyl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-amine::US10239887, Cpd. No. 29 Muscarinic acetylcholine receptor M4 Human 4053 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372291&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254485 402359232 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736173 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)Oc1ccc(F)cc1 InChI=1S/C19H16FN5OS/c1-10-11(2)23-24-19-15(10)16-17(27-19)18(22-9-21-16)25-7-14(8-25)26-13-5-3-12(20)4-6-13/h3-6,9,14H,7-8H2,1-2H3 YEVQQPKJKAUNPU-UHFFFAOYSA-N 372292 8-(3-(4-fluorophenoxy) azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 30 Muscarinic acetylcholine receptor M4 Human 2607 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372292&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254629 402359233 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736174 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)Oc1ccccc1F InChI=1S/C19H16FN5OS/c1-10-11(2)23-24-19-15(10)16-17(27-19)18(22-9-21-16)25-7-12(8-25)26-14-6-4-3-5-13(14)20/h3-6,9,12H,7-8H2,1-2H3 LBTRMBVFZDJXMM-UHFFFAOYSA-N 372293 8-(3-(2-fluorophenoxy) azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 31 Muscarinic acetylcholine receptor M4 Human 2163 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372293&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254513 402359234 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736175 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)Oc1cccc(F)c1 InChI=1S/C19H16FN5OS/c1-10-11(2)23-24-19-15(10)16-17(27-19)18(22-9-21-16)25-7-14(8-25)26-13-5-3-4-12(20)6-13/h3-6,9,14H,7-8H2,1-2H3 YGBZQRMTFVPIOB-UHFFFAOYSA-N 372294 8-(3-(3-fluorophenoxy) azetidin-1-yl)-3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazine::US10239887, Cpd. No. 32 Muscarinic acetylcholine receptor M4 Human 1757 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372294&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254619 402359235 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736176 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C1)Oc1ccccc1 InChI=1S/C19H17N5OS/c1-11-12(2)22-23-19-15(11)16-17(26-19)18(21-10-20-16)24-8-14(9-24)25-13-6-4-3-5-7-13/h3-7,10,14H,8-9H2,1-2H3 XWVVACLVEXDKJG-UHFFFAOYSA-N 372295 3,4-dimethyl-8-(3- phenoxyazetidin-1-yl) pyrimido[4',5':4,5]thieno [2,3-c]pyridazine::US10239887, Cpd. No. 33 Muscarinic acetylcholine receptor M4 Human 4429 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372295&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254767 402359236 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736177 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(C)(O)C1 InChI=1S/C14H15N5OS/c1-7-8(2)17-18-13-9(7)10-11(21-13)12(16-6-15-10)19-4-14(3,20)5-19/h6,20H,4-5H2,1-3H3 DOJYVSRRBUDOIA-UHFFFAOYSA-N 372296 1-(3,4-dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)-3- methylazetidin-3-ol::US10239887, Cpd. No. 34 Muscarinic acetylcholine receptor M4 Human 660 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372296&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254520 402359237 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736178 CC(=O)N1CC(C1)Nc1ncnc2c1sc1nnc(C)c(C)c21 InChI=1S/C15H16N6OS/c1-7-8(2)19-20-15-11(7)12-13(23-15)14(17-6-16-12)18-10-4-21(5-10)9(3)22/h6,10H,4-5H2,1-3H3,(H,16,17,18) GZNZXXCFDAJAAG-UHFFFAOYSA-N 372297 1-(3-((3,4- dimethylpyrimido [4',5':4,5]thieno[2,3-c] pyridazin-8-yl)amino) azetidin-1-yl)ethan- 1-one::US10239887, Cpd. No. 35 Muscarinic acetylcholine receptor M4 Human 53.0 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372297&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254753 402359238 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736179 Cc1nnc2sc3c(ncnc3c2c1C)N1CC(=O)C1 InChI=1S/C13H11N5OS/c1-6-7(2)16-17-13-9(6)10-11(20-13)12(15-5-14-10)18-3-8(19)4-18/h5H,3-4H2,1-2H3 RVRKFEZVPZVIOT-UHFFFAOYSA-N 372298 US10239887, Cpd. No. 36 Muscarinic acetylcholine receptor M4 Human 1001 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372298&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254865 402359239 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736180 Cc1nc2oc3c(NC4CC(F)(F)C4)ncnc3c2c(C)c1Cl InChI=1S/C15H13ClF2N4O/c1-6-9-11-12(23-14(9)21-7(2)10(6)16)13(20-5-19-11)22-8-3-15(17,18)4-8/h5,8H,3-4H2,1-2H3,(H,19,20,22) JXAKJRZDTGEFJR-UHFFFAOYSA-N 372299 8-chloro-N-(3,3-difluorocyclobutyl)-7,9-dimethyl-pyrido[3′,2′:4,5]furo[3,2-d]pyrimidin-4-amine ::US10239887, Cpd. No. 37 Muscarinic acetylcholine receptor M4 Human 406 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372299&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254775 402359240 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736181 Cc1nc2oc3c(NC4CC4)ncnc3c2c(C)c1Cl InChI=1S/C14H13ClN4O/c1-6-9-11-12(20-14(9)18-7(2)10(6)15)13(17-5-16-11)19-8-3-4-8/h5,8H,3-4H2,1-2H3,(H,16,17,19) VGCWSYQSDJETQR-UHFFFAOYSA-N 372300 8-chloro-N-cyclopropyl- 7,9-dimethyl-pyrido [3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 38 Muscarinic acetylcholine receptor M4 Human 56.5 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372300&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254495 402359241 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736182 Cc1nc2oc3c(NCc4ccc(cc4)C(C)(C)O)ncnc3c2c(C)c1Cl InChI=1S/C21H21ClN4O2/c1-11-15-17-18(28-20(15)26-12(2)16(11)22)19(25-10-24-17)23-9-13-5-7-14(8-6-13)21(3,4)27/h5-8,10,27H,9H2,1-4H3,(H,23,24,25) IUUYXGSZHJMWIS-UHFFFAOYSA-N 372301 2-[4-[[(8-chloro-7,9- dimethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin-4- yl)amino]methyl]phenyl] propan-2-ol::US10239887, Cpd. No. 39 Muscarinic acetylcholine receptor M4 Human 110 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372301&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254511 402359242 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736183 Cc1nc2oc3c(NC4CC4(C)C)ncnc3c2c(C)c1Cl InChI=1S/C16H17ClN4O/c1-7-10-12-13(22-15(10)20-8(2)11(7)17)14(19-6-18-12)21-9-5-16(9,3)4/h6,9H,5H2,1-4H3,(H,18,19,21) HLKSDLAHEZOSRG-UHFFFAOYSA-N 372302 8-chloro-N-(2,2- dimethylcyclopropyl)- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 40 Muscarinic acetylcholine receptor M4 Human 109 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372302&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254780 402359243 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736184 CCC1CC1Nc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C16H17ClN4O/c1-4-9-5-10(9)21-15-14-13(18-6-19-15)11-7(2)12(17)8(3)20-16(11)22-14/h6,9-10H,4-5H2,1-3H3,(H,18,19,21) TWZJEAXBIHOTPC-UHFFFAOYSA-N 372303 8-chloro-N- (2-ethylcyclopropyl)-7,9- dimethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 41 Muscarinic acetylcholine receptor M4 Human 324 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372303&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254735 402359244 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736185 Cc1nc2oc3c(ncnc3c2c(C)c1Cl)N1CCC1 InChI=1S/C14H13ClN4O/c1-7-9-11-12(20-14(9)18-8(2)10(7)15)13(17-6-16-11)19-4-3-5-19/h6H,3-5H2,1-2H3 LZEGWRCOLVKPAS-UHFFFAOYSA-N 372304 4-(azetidin-1-yl)-8- chloro-7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidine hydrochloride::US10239887, Cpd. No. 42 Muscarinic acetylcholine receptor M4 Human 269 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372304&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254994 402359245 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736186 CN(C)c1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C13H13ClN4O/c1-6-8-10-11(12(18(3)4)16-5-15-10)19-13(8)17-7(2)9(6)14/h5H,1-4H3 MBUKUGPROKSRMF-UHFFFAOYSA-N 372305 8-chloro-N,N,7,9- tetramethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 43 Muscarinic acetylcholine receptor M4 Human 1390 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372305&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254801 402359246 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736187 CNc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C12H11ClN4O/c1-5-7-9-10(11(14-3)16-4-15-9)18-12(7)17-6(2)8(5)13/h4H,1-3H3,(H,14,15,16) WMEZOXZKCLDWFZ-UHFFFAOYSA-N 372306 8-chloro-N,7,9-trimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 44 Muscarinic acetylcholine receptor M4 Human 1690 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372306&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254435 402359247 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736188 CCCNc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C14H15ClN4O/c1-4-5-16-13-12-11(17-6-18-13)9-7(2)10(15)8(3)19-14(9)20-12/h6H,4-5H2,1-3H3,(H,16,17,18) IEBAWYDHVXYMGL-UHFFFAOYSA-N 372307 8-chloro-7,9-dimethyl-N- propyl-pyrido[3',2':4,5]furo [3,2-d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 45 Muscarinic acetylcholine receptor M4 Human 358 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372307&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254540 402359248 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736189 CC(C)CNc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C15H17ClN4O/c1-7(2)5-17-14-13-12(18-6-19-14)10-8(3)11(16)9(4)20-15(10)21-13/h6-7H,5H2,1-4H3,(H,17,18,19) NYWDGHBQRFVTSN-UHFFFAOYSA-N 372309 8-chloro-N-isobutyl- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 46 Muscarinic acetylcholine receptor M4 Human 601 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372309&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254870 402359250 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736190 CCNc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C13H13ClN4O/c1-4-15-12-11-10(16-5-17-12)8-6(2)9(14)7(3)18-13(8)19-11/h5H,4H2,1-3H3,(H,15,16,17) WPCOBTNYSYNIPX-UHFFFAOYSA-N 372310 8-chloro-N-ethyl- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 47 Muscarinic acetylcholine receptor M4 Human 1250 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372310&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254534 402359251 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736191 Cc1nc2oc3c(ncnc3c2c(C)c1Cl)N1CCCC1 InChI=1S/C15H15ClN4O/c1-8-10-12-13(21-15(10)19-9(2)11(8)16)14(18-7-17-12)20-5-3-4-6-20/h7H,3-6H2,1-2H3 SDUQNCWDRFSHQD-UHFFFAOYSA-N 372311 8-chloro-7,9-dimethyl- 4-pyrrolidin-1-yl- pyrido[3',2':4,5]furo[3,2-d] pyrimidine hydrochloride::US10239887, Cpd. No. 48 Muscarinic acetylcholine receptor M4 Human 2530 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372311&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254814 402359252 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736192 Cc1nc2oc3c(NC4CCC4)ncnc3c2c(C)c1Cl InChI=1S/C15H15ClN4O/c1-7-10-12-13(21-15(10)19-8(2)11(7)16)14(18-6-17-12)20-9-4-3-5-9/h6,9H,3-5H2,1-2H3,(H,17,18,20) CURBYQKFAPXXTN-UHFFFAOYSA-N 372312 8-chloro-N-cyclobutyl- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2-d] pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 49 Muscarinic acetylcholine receptor M4 Human 695 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372312&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254579 402359253 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736193 Cc1nc2oc3c(NC4CCCC4)ncnc3c2c(C)c1Cl InChI=1S/C16H17ClN4O/c1-8-11-13-14(22-16(11)20-9(2)12(8)17)15(19-7-18-13)21-10-5-3-4-6-10/h7,10H,3-6H2,1-2H3,(H,18,19,21) JNMPLROUYXDEER-UHFFFAOYSA-N 372313 8-chloro-N-cyclopentyl-7,9- dimethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 50 Muscarinic acetylcholine receptor M4 Human 593 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372313&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254751 402359254 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736194 Cc1nc2oc3c(NC4CC4c4ccc(F)c(F)c4)ncnc3c2c(C)c1Cl InChI=1S/C20H15ClF2N4O/c1-8-15-17-18(28-20(15)26-9(2)16(8)21)19(25-7-24-17)27-14-6-11(14)10-3-4-12(22)13(23)5-10/h3-5,7,11,14H,6H2,1-2H3,(H,24,25,27) NUIQEBIRCZXHQJ-UHFFFAOYSA-N 372314 8-chloro-N-[2-(3,4- difluorophenyl)cyclopropyl]- 7,9-dimethyl-pyrido [3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 51 Muscarinic acetylcholine receptor M4 Human 7840 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372314&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254866 402359255 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736195 Cc1nc2oc3c(NCC4CCC4)ncnc3c2c(C)c1Cl InChI=1S/C16H17ClN4O/c1-8-11-13-14(22-16(11)21-9(2)12(8)17)15(20-7-19-13)18-6-10-4-3-5-10/h7,10H,3-6H2,1-2H3,(H,18,19,20) DQWDTFAHLHVSGG-UHFFFAOYSA-N 372315 8-chloro-N-(cyclobutyl- methyl)-7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 52 Muscarinic acetylcholine receptor M4 Human 1530 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372315&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254441 402359256 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736196 COCCCNc1ncnc2c1oc1nc(C)c(Cl)c(C)c21 InChI=1S/C15H17ClN4O2/c1-8-10-12-13(22-15(10)20-9(2)11(8)16)14(19-7-18-12)17-5-4-6-21-3/h7H,4-6H2,1-3H3,(H,17,18,19) JMDBVGXIHIQKBU-UHFFFAOYSA-N 372316 8-chloro-N-(3- methoxypropyl)-7,9- dimethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 53 Muscarinic acetylcholine receptor M4 Human 365 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372316&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254792 402359257 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736197 Cc1ncc(CNc2ncnc3c2oc2nc(C)c(Cl)c(C)c32)cn1 InChI=1S/C17H15ClN6O/c1-8-12-14-15(25-17(12)24-9(2)13(8)18)16(23-7-22-14)21-6-11-4-19-10(3)20-5-11/h4-5,7H,6H2,1-3H3,(H,21,22,23) JGZNIIJLHRKBPQ-UHFFFAOYSA-N 372317 8-chloro-7,9-dimethyl-N-[(2- methylpyrimidin-5- yl)methyl]pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 54 Muscarinic acetylcholine receptor M4 Human 1190 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372317&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254668 402359258 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736198 Cc1cc(C)c2c(n1)oc1c(NC3CCC3)ncnc21 InChI=1S/C15H16N4O/c1-8-6-9(2)18-15-11(8)12-13(20-15)14(17-7-16-12)19-10-4-3-5-10/h6-7,10H,3-5H2,1-2H3,(H,16,17,19) YQYYNPJSSNFDBB-UHFFFAOYSA-N 372318 N-Cyclobutyl-7,9-dimethyl-pyrido[3′,2′:4,5]furo[3,2-d]pyrimidin-4-amine ::US10239887, Cpd. No. 55 Muscarinic acetylcholine receptor M4 Human 1590 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372318&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254492 402359259 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736199 Cc1cc(C)c2c(n1)oc1c(ncnc21)N1CC2(COC2)C1 InChI=1S/C16H16N4O2/c1-9-3-10(2)19-15-11(9)12-13(22-15)14(18-8-17-12)20-4-16(5-20)6-21-7-16/h3,8H,4-7H2,1-2H3 HVNGJFOBKKKHLP-UHFFFAOYSA-N 372319 7,9-dimethyl-4-(2-oxa-6- azaspiro[3.3]heptan-6- yl)pyrido[3',2':4,5]furo[3,2- d]pyrimidine::US10239887, Cpd. No. 56 Muscarinic acetylcholine receptor M4 Human 3370 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372319&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254987 402359260 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736200 Cc1cc(C)c2c(n1)oc1c(NCc3cccc(c3)C(C)(C)O)ncnc21 InChI=1S/C21H22N4O2/c1-12-8-13(2)25-20-16(12)17-18(27-20)19(24-11-23-17)22-10-14-6-5-7-15(9-14)21(3,4)26/h5-9,11,26H,10H2,1-4H3,(H,22,23,24) YFGQOYBNZXBYGD-UHFFFAOYSA-N 372320 2-[3-[[(7,9- dimethylpyrido[3',2':4,5]furo d[3,2-]pyrimidin-4- yl)amino]methyl]phenyl] propan-2-ol::US10239887, Cpd. No. 57 Muscarinic acetylcholine receptor M4 Human 4270 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372320&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254760 402359261 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736201 Cc1cc(C)c2c(n1)oc1c(NC3CN(C3)c3ncc(F)cn3)ncnc21 InChI=1S/C18H16FN7O/c1-9-3-10(2)24-17-13(9)14-15(27-17)16(23-8-22-14)25-12-6-26(7-12)18-20-4-11(19)5-21-18/h3-5,8,12H,6-7H2,1-2H3,(H,22,23,25) VJTWWIBQSOSNCG-UHFFFAOYSA-N 372322 N-[1-(5-fluoropyrimidin-2- yl)azetidin-3-yl]-7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 59 Muscarinic acetylcholine receptor M4 Human 2110 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372322&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254770 402359263 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736202 Cc1cc(C)c2c(n1)oc1c(NC3CN(C3)c3cc(Cl)ncc3Cl)ncnc21 InChI=1S/C19H16Cl2N6O/c1-9-3-10(2)25-19-15(9)16-17(28-19)18(24-8-23-16)26-11-6-27(7-11)13-4-14(21)22-5-12(13)20/h3-5,8,11H,6-7H2,1-2H3,(H,23,24,26) GFLVZKRXMPGMCE-UHFFFAOYSA-N 372323 N-[1-(2,5-dichloro-4- pyridyl)azetidin-3-yl]- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine dihydrochloride::US10239887, Cpd. No. 60 Muscarinic acetylcholine receptor M4 Human 1490 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372323&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254644 402359264 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736203 Cc1cc(C)c2c(n1)oc1c(NC3CC3c3ccc(F)c(F)c3)ncnc21 InChI=1S/C20H16F2N4O/c1-9-5-10(2)25-20-16(9)17-18(27-20)19(24-8-23-17)26-15-7-12(15)11-3-4-13(21)14(22)6-11/h3-6,8,12,15H,7H2,1-2H3,(H,23,24,26) NPGACUZIHBTGMH-UHFFFAOYSA-N 372324 N-[2-(3,4-dichloro- phenyl)cyclopropyl]-7,9- dimethyl-pyrido[3',2':4,5] furo[3,2-d]pyrimidin- 4-amine hydrochloride::US10239887, Cpd. No. 61 Muscarinic acetylcholine receptor M4 Human 3380 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372324&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254819 402359265 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736204 Cc1cc(C)c2c(n1)oc1c(NC3CC3)ncnc21 InChI=1S/C14H14N4O/c1-7-5-8(2)17-14-10(7)11-12(19-14)13(16-6-15-11)18-9-3-4-9/h5-6,9H,3-4H2,1-2H3,(H,15,16,18) BVYRRMVNROXPGA-UHFFFAOYSA-N 372325 N-cyclopropyl-7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine hydrochloride::US10239887, Cpd. No. 62 Muscarinic acetylcholine receptor M4 Human 2600 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372325 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372325&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254562 402359266 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736205 Cc1nnc2oc3c(NC4CN(C4)c4ncc(cn4)C(F)(F)F)ncnc3c2c1C InChI=1S/C18H15F3N8O/c1-8-9(2)27-28-16-12(8)13-14(30-16)15(25-7-24-13)26-11-5-29(6-11)17-22-3-10(4-23-17)18(19,20)21/h3-4,7,11H,5-6H2,1-2H3,(H,24,25,26) ZAMOBUARVGIEQA-UHFFFAOYSA-N 372326 N-[1-(5-Fluoropyrimidin-2-yl)azetidin-3-yl]-3,4-dimethyl-pyrimido[4′,5′:4,5]furo[2,3-c]pyridazin-8-amine ::US10239887, Cpd. No. 63 Muscarinic acetylcholine receptor M4 Human 284 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372326&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132266625 402359267 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736206 Cc1nnc2oc3c(NCc4ccc(cc4)C4(O)CCC4)ncnc3c2c1C InChI=1S/C21H21N5O2/c1-12-13(2)25-26-20-16(12)17-18(28-20)19(24-11-23-17)22-10-14-4-6-15(7-5-14)21(27)8-3-9-21/h4-7,11,27H,3,8-10H2,1-2H3,(H,22,23,24) WWTRJZJOPXJGHD-UHFFFAOYSA-N 372327 1-[4-[[(3,4- dimethylpyrimido [4',5':4,5]furo[2,3- c]pyridazin-8- yl)amino]methyl]phenyl] cyclobutanol::US10239887, Cpd. No. 64 Muscarinic acetylcholine receptor M4 Human 862 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372327&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254745 402359268 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736207 Cc1nnc2oc3c(NCc4ccc(cc4)C(C)(C)O)ncnc3c2c1C InChI=1S/C20H21N5O2/c1-11-12(2)24-25-19-15(11)16-17(27-19)18(23-10-22-16)21-9-13-5-7-14(8-6-13)20(3,4)26/h5-8,10,26H,9H2,1-4H3,(H,21,22,23) SYXMZJGDWAFAPE-UHFFFAOYSA-N 372328 2-[4-[[(3,4-dimethylpyrimido[4′,5′:4,5]furo[2,3-c]pyridazin-8-yl)amino]methyl]phenyl]propan-2-ol ::US10239887, Cpd. No. 65 Muscarinic acetylcholine receptor M4 Human 2290 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372328&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254685 402359269 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736208 Cc1nnc2oc3c(NCc4cccc(c4)C4(O)CCC4)ncnc3c2c1C InChI=1S/C21H21N5O2/c1-12-13(2)25-26-20-16(12)17-18(28-20)19(24-11-23-17)22-10-14-5-3-6-15(9-14)21(27)7-4-8-21/h3,5-6,9,11,27H,4,7-8,10H2,1-2H3,(H,22,23,24) DVNDRAGDMLGYHD-UHFFFAOYSA-N 372329 1-[3-[[(3,4- dimethylpyrimido [4',5':4,5]furo[2,3- c]pyridazin-8- yl)amino]methyl] phenyl]cyclobutanol::US10239887, Cpd. No. 66 Muscarinic acetylcholine receptor M4 Human 1360 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372329 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372329&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254849 402359270 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736209 Cc1nnc2oc3c(NCc4cccc(c4)C(C)(C)O)ncnc3c2c1C InChI=1S/C20H21N5O2/c1-11-12(2)24-25-19-15(11)16-17(27-19)18(23-10-22-16)21-9-13-6-5-7-14(8-13)20(3,4)26/h5-8,10,26H,9H2,1-4H3,(H,21,22,23) WKTWXXBUJIGOBB-UHFFFAOYSA-N 372330 2-[3-[[(3,4- dimethylpyrimido [4',5':4,5]furo[2,3- c]pyridazin-8- yl)amino]methyl] phenyl]propan-2-ol::US10239887, Cpd. No. 67 Muscarinic acetylcholine receptor M4 Human 1700 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372330 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372330&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254496 402359271 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736210 Cc1nnc2oc3c(NC4CC4)ncnc3c2c1C InChI=1S/C13H13N5O/c1-6-7(2)17-18-13-9(6)10-11(19-13)12(15-5-14-10)16-8-3-4-8/h5,8H,3-4H2,1-2H3,(H,14,15,16) YMXTUBVGNAAKRW-UHFFFAOYSA-N 372331 N-cyclopropyl-3,4- dimethyl-pyrimido [4',5':4,5]furo[2,3- c]pyridazin-8-amine::US10239887, Cpd. No. 68 Muscarinic acetylcholine receptor M4 Human 1310 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372331 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372331&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254817 402359272 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736211 Cc1nnc2oc3c(NC4CCC4)ncnc3c2c1C InChI=1S/C14H15N5O/c1-7-8(2)18-19-14-10(7)11-12(20-14)13(16-6-15-11)17-9-4-3-5-9/h6,9H,3-5H2,1-2H3,(H,15,16,17) GYHBVTPZZIVPFM-UHFFFAOYSA-N 372332 N-cyclobutyl-3,4- dimethyl-pyrimido [4',5':4,5]furo[2,3- c]pyridazin-8-amine::US10239887, Cpd. No. 69 Muscarinic acetylcholine receptor M4 Human 1530 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372332 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372332&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254444 402359273 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736212 Cc1nnc2oc3c(NC4CCCC4)ncnc3c2c1C InChI=1S/C15H17N5O/c1-8-9(2)19-20-15-11(8)12-13(21-15)14(17-7-16-12)18-10-5-3-4-6-10/h7,10H,3-6H2,1-2H3,(H,16,17,18) DYGBCLUSWZDPRQ-UHFFFAOYSA-N 372333 N-cyclopentyl-3,4- dimethyl-pyrimido [4',5':4,5]furo[2,3- c]pyridazin-8-amine::US10239887, Cpd. No. 70 Muscarinic acetylcholine receptor M4 Human 818 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372333 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372333&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254456 402359274 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736213 Cc1nnc2oc3c(NC4CC5(COC5)C4)ncnc3c2c1C InChI=1S/C16H17N5O2/c1-8-9(2)20-21-15-11(8)12-13(23-15)14(18-7-17-12)19-10-3-16(4-10)5-22-6-16/h7,10H,3-6H2,1-2H3,(H,17,18,19) OYLOEBOVNRBQDR-UHFFFAOYSA-N 372334 3,4-dimethyl-N-(2- oxaspiro[3.3]heptan-6- yl)pyrimido[4',5':4,5] furo[2,3-c]pyridazin- 8-amine::US10239887, Cpd. No. 71 Muscarinic acetylcholine receptor M4 Human >10000 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372334&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254813 402359275 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736214 Cc1nnc2oc3c(NC4CC(F)(F)C4)ncnc3c2c1C InChI=1S/C14H13F2N5O/c1-6-7(2)20-21-13-9(6)10-11(22-13)12(18-5-17-10)19-8-3-14(15,16)4-8/h5,8H,3-4H2,1-2H3,(H,17,18,19) RZCMIYNSGSGGLB-UHFFFAOYSA-N 372335 N-(3,3-difluorocyclobutyl)- 3,4-dimethyl-pyrimido [4',5':4,5]furo[2,3- c]pyridazin-8-amine::US10239887, Cpd. No. 72 Muscarinic acetylcholine receptor M4 Human 1750 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372335 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372335&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254597 402359276 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736215 Cc1nnc2oc3c(ncnc3c2c1C)N1CC2(COC2)C1 InChI=1S/C15H15N5O2/c1-8-9(2)18-19-14-10(8)11-12(22-14)13(17-7-16-11)20-3-15(4-20)5-21-6-15/h7H,3-6H2,1-2H3 XJLZKSMKNVJVBC-UHFFFAOYSA-N 372336 3,4-dimethyl-8-(2-oxa-6- azaspiro[3.3]heptan-6- yl)pyrimido[4',5':4,5]furo [2,3-c]pyridazine::US10239887, Cpd. No. 73 Muscarinic acetylcholine receptor M4 Human 4840 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372336 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372336&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254549 402359277 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736216 Cc1nnc2oc3c(NCc4ccc(nc4)C(C)(C)O)ncnc3c2c1C InChI=1S/C19H20N6O2/c1-10-11(2)24-25-18-14(10)15-16(27-18)17(23-9-22-15)21-8-12-5-6-13(20-7-12)19(3,4)26/h5-7,9,26H,8H2,1-4H3,(H,21,22,23) NACUTSDVNRXLOS-UHFFFAOYSA-N 372337 2-[5-[[(3,4- dimethylpyrimido [4',5':4,5]furo[2,3- c]pyridazin-8-yl)amino] methyl]-2- pyridyl]propan-2-ol::US10239887, Cpd. No. 74 Muscarinic acetylcholine receptor M4 Human 9160 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372337 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372337&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132254654 402359278 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7 736217 COc1ccc(CNc2ncnc3c2oc2nnc(C)c(C)c32)cc1F InChI=1S/C18H16FN5O2/c1-9-10(2)23-24-18-14(9)15-16(26-18)17(22-8-21-15)20-7-11-4-5-13(25-3)12(19)6-11/h4-6,8H,7H2,1-3H3,(H,20,21,22) DQZNRAHVIPBUFB-UHFFFAOYSA-N 372338 N-[(3-fluoro-4-methoxy- phenyl)methyl]-3,4-dimethyl- pyrimido[4',5':4,5]furo[2,3- c]pyridazin-8-amine::US10239887, Cpd. No. 75 Muscarinic acetylcholine receptor M4 Human 1070 US Patent 10.7270/Q2W09880 aid1798173 US10239887 Lindsley, CW; Conn, PJ; Engers, DW; Bollinger, S; Tarr, JC; Spearing, P; Engers, JL; Long, M; Bridges, TM 3/26/2019 12/30/2019 Vanderbilt University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=372338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000377&target=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=372338&enzyme=Muscarinic+acetylcholine+receptor+M4&column=ki&startPg=0&Increment=50&submit=Search 132255034 402359279 1 MANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR 7TRK,7TRP,7TRQ,7TRS Muscarinic acetylcholine receptor M4 ACM4_HUMAN P08173 B2RPP4 Q0VD60 Q4VBK7