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 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 of Ligand PubChem SID of Ligand 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 PDB ID(s) of Target Chain UniProt (SwissProt) Recommended Name of Target Chain UniProt (SwissProt) Entry Name of Target Chain UniProt (SwissProt) Primary ID of Target Chain UniProt (SwissProt) Secondary ID(s) of Target Chain UniProt (SwissProt) Alternative ID(s) of Target Chain UniProt (TrEMBL) Submitted Name of Target Chain UniProt (TrEMBL) Entry Name of Target Chain UniProt (TrEMBL) Primary ID of Target Chain UniProt (TrEMBL) Secondary ID(s) of Target Chain UniProt (TrEMBL) Alternative ID(s) of Target Chain 173659 Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(c4)S([O-])(=O)=O)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-9-8-14(11-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/p-3 JQYMGXZJTCOARG-UHFFFAOYSA-K 50029031 1-Amino-4-{4-[4-chloro-6-(3-sulfo-phenylamino)-[1,3,5]triazin-2-ylamino]-3-sulfo-phenylamino}-9,10-dioxo-9,10-dihydro-anthracene-2-sulfonic acid1-Amino-4-{4-[4-chloro-6-(4-sulfo-phenylamino)-[1,3,5]triazin-2-ylamino]-3-sulfo-phenylamino}-9,10-dioxo-9,10-dihydro-anthracene-2-sulfonic acid::CHEMBL223344::CID44285648::basilen blue::cibacron blue (mixer, meta and para isomers P2X purinoceptor 4 Rattus 46.2 PDSP Ki 10.1124/mol.51.1.109 10.7270/Q218351B 9016352 Garcia-Guzman, M; Soto, F; Gomez-Hernandez, JM; Lund, PE; Stuhmer, W Max-Planck Institute for Experimental Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029031&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 44285647 103938145 CHEMBL223344 C13746 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 173660 Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2ccccc12)c1cc(Br)c(O)c(Br)c1 InChI=1S/C19H10Br4O5S/c20-12-5-9(6-13(21)17(12)24)19(10-7-14(22)18(25)15(23)8-10)11-3-1-2-4-16(11)29(26,27)28-19/h1-8,24-25H UDSAIICHUKSCKT-UHFFFAOYSA-N 85044 Bromphenol blue::Brophenol Blue::CAS_115-39-9::CAS_8272::NSC_8272 P2X purinoceptor 4 Rattus 301.5 PDSP Ki 10.1124/mol.51.1.109 10.7270/Q218351B 9016352 Garcia-Guzman, M; Soto, F; Gomez-Hernandez, JM; Lund, PE; Stuhmer, W Max-Planck Institute for Experimental Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=85044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=85044&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 8272 136351144 59424 ZINC04215094 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 173663 Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4ccccc4S(O)(=O)=O)n3)c(c2)S(O)(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S(O)(=O)=O InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-16-7-3-4-8-19(16)49(40,41)42)37-29(36-27)34-17-10-9-13(11-20(17)50(43,44)45)32-18-12-21(51(46,47)48)24(31)23-22(18)25(38)14-5-1-2-6-15(14)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37) YKCWQPZFAFZLBI-UHFFFAOYSA-N 50300129 CHEMBL572528::CIBACRON BLUE::Cibacron Blue 3Ga P2X purinoceptor 4 Rattus 128.3 PDSP Ki 10.1124/mol.51.1.109 10.7270/Q218351B 9016352 Garcia-Guzman, M; Soto, F; Gomez-Hernandez, JM; Lund, PE; Stuhmer, W Max-Planck Institute for Experimental Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300129&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search CBD 20GS,3VI7,4CF6,1QRD,3W78 172469 104154490 CHEMBL572528 DB02633 ZINC85427635 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 173665 Cc1nc(N=Nc2ccc(cc2S(O)(=O)=O)S(O)(=O)=O)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C14H14N3O12PS2/c1-7-13(19)9(5-18)10(6-29-30(20,21)22)14(15-7)17-16-11-3-2-8(31(23,24)25)4-12(11)32(26,27)28/h2-5,19H,6H2,1H3,(H2,20,21,22)(H,23,24,25)(H,26,27,28) PNFZSRRRZNXSMF-UHFFFAOYSA-N 85043 CAS_149017-66-3::CHEMBL69234::NSC_6093163::PPADS P2X purinoceptor 4 Rattus 500 PDSP Ki 10.1124/mol.51.1.109 10.7270/Q218351B 9016352 Garcia-Guzman, M; Soto, F; Gomez-Hernandez, JM; Lund, PE; Stuhmer, W Max-Planck Institute for Experimental Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=85043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=85043&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5478935 136351143 CHEMBL69234 ZINC18247107 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 173667 Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/p-6 FIAFUQMPZJWCLV-UHFFFAOYSA-H 50000029 4-Methyl-8-{4-methyl-3-[3-(3-{3-[2-methyl-5-(4,6,8-trisulfo-naphthalen-1-ylcarbamoyl)-phenylcarbamoyl]-phenyl}-ureido)-benzoylamino]-benzoylamino}-naphthalene-1,3,5-trisulfonic acid; hexa-kis Sodium salt::5,5',5''-[1,3,6-naphthalenetriyltris(sulfonylimino)]tris[1,3-benzenesulfonate analogue::CHEMBL265502::SURAMIN HEXASODIUM::Suramin sodium::suramin::suramin Na P2X purinoceptor 4 Rattus 500 PDSP Ki 10.1124/mol.51.1.109 10.7270/Q218351B 9016352 Garcia-Guzman, M; Soto, F; Gomez-Hernandez, JM; Lund, PE; Stuhmer, W Max-Planck Institute for Experimental Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50000029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50000029&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 3943541 103914728 CHEMBL265502 C07974 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50185340 Cc1nc(N=Nc2ccc(cc2S(O)(=O)=O)S(O)(=O)=O)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C14H14N3O12PS2/c1-7-13(19)9(5-18)10(6-29-30(20,21)22)14(15-7)17-16-11-3-2-8(31(23,24)25)4-12(11)32(26,27)28/h2-5,19H,6H2,1H3,(H2,20,21,22)(H,23,24,25)(H,26,27,28) PNFZSRRRZNXSMF-UHFFFAOYSA-N 85043 CAS_149017-66-3::CHEMBL69234::NSC_6093163::PPADS P2X purinoceptor 4 Rattus >500000 ChEMBL 10.1021/jm9904203 10.7270/Q2FN15HC 11462975 Kim, YC; Brown, SG; Harden, TK; Boyer, JL; Dubyak, G; King, BF; Burnstock, G; Jacobson, KA National Institute of Diabetes and Digestive and Kidney Diseases http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=85043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=85043&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5478935 136351143 CHEMBL69234 ZINC18247107 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50185370 Cc1nc(N=Nc2ccc(cc2S(O)(=O)=O)S(O)(=O)=O)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C14H14N3O12PS2/c1-7-13(19)9(5-18)10(6-29-30(20,21)22)14(15-7)17-16-11-3-2-8(31(23,24)25)4-12(11)32(26,27)28/h2-5,19H,6H2,1H3,(H2,20,21,22)(H,23,24,25)(H,26,27,28) PNFZSRRRZNXSMF-UHFFFAOYSA-N 85043 CAS_149017-66-3::CHEMBL69234::NSC_6093163::PPADS P2X purinoceptor 4 Rattus 2600 ChEMBL 10.1021/jm9904203 10.7270/Q2FN15HC 11462975 Kim, YC; Brown, SG; Harden, TK; Boyer, JL; Dubyak, G; King, BF; Burnstock, G; Jacobson, KA National Institute of Diabetes and Digestive and Kidney Diseases http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=85043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=85043&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5478935 136351143 CHEMBL69234 ZINC18247107 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50203169 Cc1nc(N=Nc2ccc(C(O)=O)c(Cl)c2)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C15H13ClN3O8P/c1-7-13(21)10(5-20)11(6-27-28(24,25)26)14(17-7)19-18-8-2-3-9(15(22)23)12(16)4-8/h2-5,21H,6H2,1H3,(H,22,23)(H2,24,25,26) KMRWDYZPXRUNAQ-UHFFFAOYSA-N 50118234 CHEMBL129904::MRS 2160 P2X purinoceptor 4 Rattus 1600 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118234&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 15353879 104011571 CHEMBL129904 ZINC04392986 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50806925 Cc1ncc(COP(O)(O)=O)c(C=O)c1O InChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14) NGVDGCNFYWLIFO-UHFFFAOYSA-N 50118216 (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate::CHEMBL82202::pyridoxal 5'-(dihydrogen phosphate)::pyridoxal 5'-phosphate P2X purinoceptor 4 Rattus 219000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118216&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search PLP 1W23,7X52,7X51,2DAB,1TZ2,1TZM,1O61,6RV1,3E9K,3BD8,5HNE,1DGE,1NRG,6THQ,2CFT,2YOB,1DAA,3GJU,1PG8,1E4O,7XOH,3JZ6,8G1Y,2Z20,1BKS,1RVY,1RVU,4QGR,1WW3,1WW2,2SKC,2SKD,2SKE,1JS6,7ME8,1JS3,8SNJ,8SNG,5B53,6XWL,6XWB,5G2P,6ENZ,2EH6,6CGQ,1DKA,1GFZ,1OHW,1OHY,4QYS,7EIY,2C2B,2C2G,6M5W,2QGH,3DDW,3DDS,3DD1,3G8M,6SSD,5MEM,1AKA,1QU4,3II0,7KMC,1M32,5LH9,1I48,1I43,7TA1,2F3Q,7KB1,7K0J,7K0K,7K0I,1HLF,2A1H,3TFT,4FL0,1N2T,7DBE,1Z62,1YOO,4M2M,4M2K,4M2J,5HXX,3NYS,7KH2,4BF5,6F5V,1ET0,5LUC,6CZZ,6QKB,3ISL,2D7Z,2D7Y,7YEO,1W7M,1W7L,1VE1,1VE5,3VSD,3VSC,3VSA,2X8U,7NWB,7NWC,7NWA,6W1D,1CZC,1CZE,1T3I,8EMS,8BIV,2HHF,5LNR,3I5T,7S3G,7S3F,2Z1Z,2Z1Y,4BQF,4BQI,2VGS,2VGU,2VGT,2VGW,2VGV,2VGZ,1WV0,1WV1,4ZLV,1U08,8E9V,8E9T,8E9R,8E9P,8E9Q,8E9N,8E9L,8E9M,8E9J,8E9K,8E9D,7MDB,7MD0,7MD1,7MD8,2AZD,1C9D,3TQX,2EIY,5F9S,1TZK,2ZP7,1GEX,1GEW,6NDN,5OWY,3O05,1LKC,5D5S,1RFU,4NOG,4PFF,4PFN,4YSN,2AQ6,5NM8,6EZL,1N8P,5BW6,5BWA,5BWT,5BWU,5BWV,5BWW,5BWR,5BWX,1VP4,3ZRP,3BDA,3BD7,1IAY,1IAX,4CVQ,1TDJ,5X7N,5X7M,3WQE,3WQD,3WQG,3WQF,3WQC,5M46,5M49,1N31,6N2F,6N2A,3B1D,3B1C,3LV2,3LVM,3LVL,3LVK,3LVJ,3UZO,3UZB,1IJI,5CGQ,6A6E,6A6G,6JIX,6JIF,3RBF,5O52,5O50,5O56,5O54,8AAT,4YI5,4YI3,1O4S,6I33,6I34,1MDZ,1MDX,3A2B,1KO0,2ORD,4ATQ,4ATP,7ODC,4W5K,2CH1,2CH2,4JEY,4JE5,4V15,1GBN,1KKJ,2W7H,2W7I,2W7J,2W7K,2W7L,2W7M,2W7F,2W7G,3CSW,2F3U,7UB4,2D64,2D65,2D66,2D61,2D63,3FDD,2ECO,2ECP,2ECQ,4WR3,5UID,1A3G,4XUG,3I16,1WUY,1WUT,2CST,2V03,4EB7,4EB5,1JBQ,1XKX,7MCU,7MCT,7MCP,7MCY,7MCB,7MCL,7MCN,5C3U,3F9T,1C8V,1C8L,1C8K,6O12,6O10,1QZ9,5K1R,4XEW,5QT3,5Z5C,7FJK,1BX3,7UAU,1GD9,1WBJ,1L6I,4CHI,4UQV,7P3T,4A3Q,2C4M,5I90,4DQ6,2AV6,2WK8,2WK9,1TJP,1FCJ,3L6C,3L6B,4AO9,1NOI,1NOJ,1NOK,3E77,2YXX,6JC9,6K1N,6K1L,6K1M,1LW4,1LW5,1LWN,1LWO,7TCS,1AHP,2AMV,6G4E,6G4D,6G4F,6XO2,1TZJ,1Z7W,3A9Z,3A9Y,1V2F,1V2E,3UYY,3RCH,6SMW,6GIO,2F3S,1ASN,1ASM,1ASB,1ASA,1ASG,1ASF,1ECX,1D2F,1KNW,7AGZ,1K8X,1K8Y,1K8Z,2CIN,6HBV,6T3V,6YRW,4ZGY,5B55,1CX9,2FFR,1EKV,1EKP,1EKF,5GP4,1E1Y,6XIN,1B8G,2ZY3,2ZY2,2ZY5,2ZY4,6Q6I,6KNI,4A6T,2CTZ,4CBS,4CBR,4UOX,5W71,1OAS,1OAT,2ISQ,4H67,4H6D,6ULD,1C7G,1C7N,1KMJ,3C5Q,4XAU,5XT5,2YRR,3KEU,1L7X,6MFB,5JTU,5JTT,7NBD,7NBG,7NBF,7NBC,4YUA,2AW3,5GJO,5GJP,6S4P,6S4R,6S4H,6S4K,6S4O,6FL5,3IF2,6OIA,2OO0,3B8W,3B8V,3B8U,3B8T,2DH5,3BB8,1GPA,1GPB,1YGP,1GPY,3AAT,4CTO,4CTN,4CTM,5X5H,3QBO,2ABJ,7EIX,7EIW,1HKV,6HRH,5O5C,6XNC,1AY8,1AY5,1AY4,6EWQ,5EQC,1XRS,6NZU,1I2K,5CE8,1G7X,1G77,1G76,1G79,1G78,4ZM3,4ZM4,2BYJ,2BYL,6SNU,6SNL,1EQB,2FF5,7BA4,1ARI,1ARS,1ART,6QVL,6QVG,3ELE,1KMK,4BQE,1XI9,1VFH,3GPB,5CR5,4DAA,7NY9,7NY2,1CW2,6FYQ,1TAR,5DDS,1TAT,1B9H,4LW4,1A50,1A5A,1A5S,2VD8,6Q72,6Q70,6Q71,6Q7L,6Q7M,3KKI,4A72,4UHM,4UHO,4UHN,3HQT,7NL1,7M2L,2VMU,2AY1,2AY2,2AY3,2AY4,2AY5,2AY6,2AY7,2AY8,2AY9,7V58,8AYJ,2CJH,2CJD,7Q9X,5VER,7NWM,2PB0,2PB2,2ZUK,5G0A,2HP2,1IYD,6L1L,6L1O,6L1N,5B36,4DGT,2Z67,2ATI,8SA7,8SA9,8SAD,8SAE,8SAA,8SAB,8SAC,6XDK,6S54,6S52,6S51,4HT3,5ZL6,2DKB,2NV9,2ZB2,3E5P,1IBJ,6WI2,2F3P,5YB0,7T7J,3A9X,7LM0,2O1B,1FG3,4LMB,4LMA,6HUL,2A5H,7RW3,1AXR,1GDE,2E54,2VYC,5E25,7U6U,7LKL,6KFU,3LY1,3BV0,2X3L,4OBU,2P69,2X5F,2YCT,6GKR,1H5U,6UXE,7XIN,2FET,5BJ3,5BJ4,5OWZ,1KL1,1KL2,1KL7,1XFC,7TM7,6TGH,6MRI,6MRH,6MRE,6MR2,6MR6,4JF1,4R8D,1B4X,5IJG,4B98,4PPM,3MEB,7E13,5ZWA,5C6U,5TXR,7P7X,7NWE,4E1O,6C73,3VBE,6KHP,6KHO,6KHN,3R79,4EMY,7NEA,7NEB,4Y6G,4O6Z,1UZU,2WSY,2J9Z,1C50,2JC3,7V5I,5QQU,5QQT,5QQW,5QQV,5QQQ,5QQS,5QQR,5QQY,5QQX,5QQZ,5Z83,5Z8A,5Z8K,1FC0,1FC4,1M54,7K0P,3BM5,4K6N,1IX6,1IX7,1IX8,3KGW,1L5V,1L5W,1L5Q,1L5R,1L5S,5YHV,4COO,2C7T,2XH1,3DYD,3DXW,4YWR,4Z5X,5WT2,2J66,3AWO,3AWN,1P29,1P2B,3KP1,3AOW,3AOV,1KTI,3DTG,1F2D,6F35,6F3S,6F3R,6F3U,6F3J,6F3L,7CX0,6HTE,2RKB,7RTK,1KFK,1KFB,1KFC,6QA8,6QA6,6QA7,2D1F,4L3V,1K08,1K06,3ZEI,2DGM,2DGL,2DGK,7LTP,6TM7,2CAN,7CWZ,7B4I,1TWI,2W8U,2W8T,2W8V,1P2G,6U7A,6U78,6LDR,4BMK,2E7J,2E7I,1KKP,7GPB,1SF2,1SFT,6UY5,1FS4,1I29,1P4G,1P4J,1P4H,2HP1,3PC2,1VJO,2HDK,2VMO,2VMN,2VMS,2VMR,2VMQ,2VMP,2VMW,2VMV,2VMT,2VMZ,2VMY,2VMX,4W1V,4W1W,4W1X,6KFR,6KFM,7JHW,2CLI,2CLH,2CLK,2CLE,2CLF,2SFP,6KR5,6LIG,1QIS,4GSA,3ATH,4OT8,3FHX,2FYF,4OTL,2EO5,8B06,8B03,6PK3,6PK1,1GC3,1GC4,1GCK,1WYV,1WYU,1G2W,5OG0,3DOD,1JNW,1ZOB,1ZOD,9GPB,1C4K,4ZU6,3DXV,4AH3,7SZP,1BT4,6PD2,1I1K,1I1M,1I1L,1RCQ,6GWI,5I5S,5I5U 1051 104011553 18405 CHEMBL82202 DB00114 5249 C00018 ZINC01532514 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50806948 Cc1ncc2COP(O)(=O)OCc2c1O InChI=1S/C8H10NO5P/c1-5-8(10)7-4-14-15(11,12)13-3-6(7)2-9-5/h2,10H,3-4H2,1H3,(H,11,12) KCAJHODRYGNBSX-UHFFFAOYSA-N 50064803 3-Methyl-7-oxo-5,9-dihydro-6,8-dioxa-2-aza-7lambda*5*-phospha-benzocycloheptene-4,7-diol::CHEMBL74121::MRS 2220 P2X purinoceptor 4 Rattus >100000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50064803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50064803&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 3960826 103959758 CHEMBL74121 6496 ZINC26376205 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50806950 Nc1ccc(CCSc2nc(N)c3ncn([C@@H]4O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]4O)c3n2)cc1 InChI=1S/C18H25N6O13P3S/c19-10-3-1-9(2-4-10)5-6-41-18-22-15(20)12-16(23-18)24(8-21-12)17-14(26)13(25)11(35-17)7-34-39(30,31)37-40(32,33)36-38(27,28)29/h1-4,8,11,13-14,17,25-26H,5-7,19H2,(H,30,31)(H,32,33)(H2,20,22,23)(H2,27,28,29)/t11-,13-,14-,17-/m1/s1 IAEUEMYQURUPGA-LSCFUAHRSA-N 50118226 CHEMBL337062::PAPET-ATP P2X purinoceptor 4 Rattus 15000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118226&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5310950 104011563 CHEMBL337062 C03517 ZINC49739457 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50806977 Cc1nc(N=Nc2ccc(C(O)=O)c(Cl)c2)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C15H13ClN3O8P/c1-7-13(21)10(5-20)11(6-27-28(24,25)26)14(17-7)19-18-8-2-3-9(15(22)23)12(16)4-8/h2-5,21H,6H2,1H3,(H,22,23)(H2,24,25,26) KMRWDYZPXRUNAQ-UHFFFAOYSA-N 50118234 CHEMBL129904::MRS 2160 P2X purinoceptor 4 Rattus 9600 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118234&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 15353879 104011571 CHEMBL129904 ZINC04392986 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50806989 Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 ZKHQWZAMYRWXGA-KQYNXXCUSA-N 50366480 ADENOSINE TRIPHOSPHATE::ATP P2X purinoceptor 4 Rattus 1000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50366480 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50366480&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search ATP 7UT9,1Y64,7LNU,7LN3,7LN2,7LN1,7LN0,7LN6,7LN5,7LN4,1NGE,1NGF,1NGG,1NGH,3LTA,3LTC,2NPI,2ZDQ,7NHL,1GY3,6J18,6J17,1G3I,7SGL,2BU2,2Q7G,2BUP,3H8V,6GFA,7QI6,7QI4,1H8H,4AUI,1FMW,1XDP,7ZSE,3O8L,5HNV,7ABR,3EHG,1KAZ,1KAY,1KAX,7R31,7U6Y,6TAY,6TAX,6DDZ,1XMI,1XMJ,6E0O,4A8M,4A8F,4A8Y,4A8Q,4A8S,4A8W,7JIJ,7CRC,7EKL,8H99,7N30,7N31,6YWX,6YWY,6YWE,6YW6,6YW7,6YW5,4B2Q,2W5G,2W5I,3HBT,8DAR,3CQD,4QC2,1Q97,4GY2,6FU2,1E4G,3FFK,3JZM,4CI6,1MO8,4QNR,6D3S,6D3R,7P2E,7P2Y,7V2Z,5ECQ,5ECP,4XWO,4XW5,2VHT,2VHQ,6NHX,6NHZ,6KCL,6KCM,6KC0,7JM6,7JM7,6MT9,1U5R,1I7L,1OL6,6JRS,7D4O,7D4U,7T3U,1ZAO,1Q24,6ZQM,3A5N,1PJ4,7AI5,3TPQ,7C1Z,4Q4Z,1B0U,7OQH,7LJ1,6P8J,3DGO,6ZO4,5FV0,6L59,6L57,4X6R,3R1R,7PX9,7U9X,7WTD,7WTE,7U9T,7U9K,2BBT,2BBS,2BBO,6ZTQ,4O0M,6GFH,1JKN,7NGF,7MJP,7MJQ,7MJO,1UF9,5AFU,7KSM,6UDQ,6RKE,6RKD,6RKA,7VVY,7VVZ,1KVK,4H4K,7OZ1,2OLQ,2OLR,7UUX,1NMD,1NM1,3Q60,7OIK,3BG5,3E1Y,7CGN,4GP7,1RDQ,2Q97,6ZYW,6ZYY,7W79,4DX2,3WVL,1SVM,3WV9,4DXL,6Z3R,6IUB,6IUC,5N9X,1HLU,7VLR,3JAY,6QRI,6QDV,3V2U,7AT1,7L1R,7L1S,7L1Q,6S47,6N30,7AM2,6OA9,7YFP,7YFN,7S61,7S67,7Y38,7RFH,7RFE,7RFG,6O75,6O78,1P8Z,6PTN,6PTO,7WPM,5FL7,3QUO,3QUN,4AZW,6YAR,6YAY,1G21,7EV2,7EV3,7M74,2BTF,3REP,3REU,8FHN,8FHO,7AIR,7AIQ,7AIP,3W1G,4TL7,1HCK,6HZM,7DC8,7RNR,4WTV,1AQ2,6N2Y,1NSF,1NSY,2CG9,7JGR,7JGA,5CYR,1YXQ,7FDV,7WAJ,6AB0,6AB2,6AB8,6ABK,3H5N,6YT3,6W18,6W17,6W1Z,7NZ0,7NZ3,1UEV,3T0Z,2F43,2QUI,7ZH9,8BI0,1E79,5U03,4TQD,7PO3,7RES,6CMW,2Z1U,7UJP,7UJT,7P3F,7P3N,4WAE,1TFW,1A0I,1DEJ,4M3Y,4XVU,6NOO,6NOP,6NO7,3UMP,3UMO,5J1T,8ESC,4EAJ,4EAK,4EAH,4EAG,7RAV,3G6V,6KSH,8E9B,1R9T,7MD2,6AEC,3NCQ,3MN6,3MN7,3MN5,3MN9,3UQE,3UQD,5WC0,6SYT,5WCB,4H0T,4H0V,4H0X,4H0Y,4H03,1PK8,7WYX,2FSG,7BT2,7WPT,7WPX,7WPN,7WPL,8DAV,3EQB,8CVT,4KH0,2PAV,2PAA,5EOU,5OTR,2O0H,6PAO,6PAN,6PAQ,5XVU,5FWP,5FWK,5FWL,5FWM,7CM9,7K3Z,4UP9,1TID,7Z5J,1RFQ,6ZSP,5JRJ,5LVP,5D15,6GRG,7MI6,7MI3,3SJH,2AQX,4Z94,6RJ4,3TLX,4O4F,4O4E,4O4D,7W1Y,4AN3,4KGM,4KGV,2PZE,2PZF,2PZG,3Q53,3LKI,3LKK,6PZ9,4XHO,6PZA,6PZI,7NK7,7CFI,3QO3,3QO7,7NZM,7EER,5YA1,6JD4,6JD5,5IE2,6ZXF,6ZXG,6ZXH,8DAS,8DAT,1SU2,3WQU,7QBA,5DRD,5DR2,7QO6,2R9V,4FO0,7V00,6N2Z,4FWM,1Y8R,1Y8P,1Y8Q,7KO2,7LHT,7LHW,1NYR,6BHU,6TQE,4M3T,4M3U,4M3W,4M3R,4M3X,4M3Z,2P55,1IJJ,5YZG,6JIU,6JIY,6JII,6JI0,6ZM6,6ZM5,5O5W,1F9A,8AAZ,4DLK,7QO5,7QO4,7B93,7M6L,7PW7,7M6A,7DYI,7DYE,7K2T,3C9R,1MDU,1KO5,3PGK,4AT8,4AT1,1XKV,8G8F,5XMI,5XMK,1Z0S,7VX8,7N1P,1RYR,1RYS,4FF3,6W23,6W22,6W21,6W20,6W24,4FFR,5VQA,4BJR,8DGC,4F93,6X2N,5ZTB,7R8E,7XA9,3FDX,1MIW,2Z08,2Z02,6CN2,7UIR,7P48,4KR7,3PJR,7PJI,2HMP,2HMU,2HMW,5EXY,4U07,4U0M,1WUA,7SHM,5ECK,5ECI,5ECH,5ECN,7Q6I,5LIL,7Q6F,7Q6D,3ULE,4KB6,7RGQ,6VOM,6VOL,6VOO,6VON,6VOI,6VOH,6VOK,6VOJ,6VOG,6VOF,3DKC,2GNK,3MMV,7LJF,2WPD,5V2L,5XZ9,1PHK,6O1V,7VAL,8A5P,8A5Q,1QZ5,1QZ6,3EPS,5LUH,4XBR,7PUP,7PUB,1YP3,6MAT,5X9G,5X9H,7P3W,8EOP,1LHR,1RGI,6ZR2,7WIT,3A7H,1L2T,6VTD,6VTB,7TVE,5I9E,4DQW,3CI1,3CI5,3CI4,3CIP,3CIS,6AH5,6AH4,2A84,7RZY,6RIS,6RIQ,4ZS4,2IA6,2IAJ,3ZS7,3LL3,4M9Z,4M9X,4M9Y,4M9S,7T0V,5LVO,8BX8,1MB9,2YXU,3QNO,3AB8,7ESB,2Y27,6JCU,2C01,7TCH,2C96,6Z1P,6R4S,7KL1,1ZYD,7PLJ,3M9O,4RTF,2XCW,3V01,3V04,2R86,2ILY,1N48,7W3M,7W3B,7LI3,7LI4,3Q9L,1R8B,5DK4,7U2X,2X15,5I4N,4P33,5YUD,6JH6,6JH8,6JH9,6U0M,8DGF,6IFR,2FGH,3W3D,7RL0,1ASZ,6CTA,3IQ0,4WH3,5GQL,5GQJ,8BD6,8BD4,8BD5,6TE0,4V02,4V0U,3GQK,1FQ1,6HBU,3QX9,3QXC,1U9I,5CSH,4TU0,2W00,2W02,3U8X,4ZGN,7NXV,2FF3,7K58,5T0G,5T0C,5T0J,5T0I,4GT3,7K5B,6FZB,4RQV,5ZUA,5U2H,7WIW,6RDW,7OIM,5A9P,1B8A,5A99,5A98,3X2W,3X2V,3X2U,6COM,7P5Z,7P52,7P50,2PNN,4XTR,4U1R,7ZZ3,7ZZ4,4A6X,4CBX,4CBU,4CBW,4CB0,3UC5,8FZQ,7D7Y,2RSF,6P8V,5KOY,6P80,3FPB,6EMA,2EWW,4G5Y,7ORJ,7ORK,7ORN,1B38,1B39,5Z68,5Z6R,7SXO,2PC9,7UO7,7PVN,1V1B,5L9N,3KE5,3KEU,4FXF,7NJL,7NJO,7NJN,7NJK,7NJQ,7NJS,6ZQN,5XJC,3DGL,2QKM,2QK4,2GBL,3SL2,6FML,7KZU,7KZI,5ACK,3CHW,5MWL,5MW8,5H67,5GJC,8BWY,3M3N,4HUT,7RCK,2ZHZ,7PSA,6WA8,6OIF,2OOY,4M63,7LG5,7LGQ,7LGM,6TDU,6TDY,3LMI,7JPS,7JPR,7JPQ,7JPP,7JPO,7JPN,6AWH,6AWG,4JYZ,5LXQ,6YII,6MM2,4CT2,4CT1,7T65,4CTA,6JBJ,6JBK,6JBD,3QB0,7Z3O,4IFE,3J2T,6IP2,7N74,5SVK,2A42,2A41,2A40,5OBJ,5NBN,5NBM,5NBL,1AYL,7VX0,7N6I,1KXP,1N5I,1N56,6N0T,7LJL,1V3S,7U1E,7U1S,7U1Q,2X0Q,3U9D,6AZ0,5CE3,1TQP,8APF,6JWY,6JWQ,6JWS,6JWT,6JWW,6JWV,5D4C,2XSZ,6U1D,6U1E,6U1F 5957 160845582 15422 C03517 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807008 Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(S)=O)[C@@H](O)[C@H]1O InChI=1S/C10H16N5O12P3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(25-10)1-24-28(18,19)26-29(20,21)27-30(22,23)31/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)(H2,22,23,31)/t4-,6-,7-,10-/m1/s1 NLTUCYMLOPLUHL-KQYNXXCUSA-N 50118217 ADENOSINE-5'-DIPHOSPHATE MONOTHIOPHOSPHATE::ATP-gammaS::ATPgammaS::CHEMBL131890::PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER P2X purinoceptor 4 Rattus 2300 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118217&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search ATG 440317 104011554 CHEMBL131890 C01469 ZINC24424495 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807009 Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80) FIAFUQMPZJWCLV-UHFFFAOYSA-N 50336799 5,5',5''-[1,3,6-naphthalenetriyltris(sulfonylimino)]tris[1,3-benzenesulfonate analogue::8,8'-(Carbonylbis(imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino))bisnaphthalene-1,3,5-trisulphonic acid::8,8'-[CARBONYLBIS[IMINO-3,1-PHENYLENECARBONYLIMINO(4-METHYL-3,1-PHENYLENE)CARBONYLIMINO]]BIS-1,3,5-NAPHTHALENETRISULFONIC ACID::8,8'-[Carbonylbis[imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonyl-imino]]bis-1,3,5-naphthalenetrisulfonic acid(suramin)::8-[(4-methyl-3-{[3-({[3-({2-methyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)phenyl]carbamoyl}amino)benzene]amido}benzene)amido]naphthalene-1,3,5-trisulfonic acid::CHEMBL265502::Germanin::Suramin hexasodium::US8835659, Suramin::Urea derivative::suramin P2X purinoceptor 4 Rattus >100000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336799&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search SVR 2H9T,7YET,4YV5,4X3U,3BJW,7AH8,6Z7B,3PP7,1Y4L,3GAN,6CE2,4J4V,2NYR,3BF6,3UR0 5361 125086901 45906 CHEMBL265502 DB04786 1728 C07974 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807017 Cc1nc(N=Nc2ccc(cc2S(O)(=O)=O)S(O)(=O)=O)c(COP(O)(O)=O)c(C=O)c1O InChI=1S/C14H14N3O12PS2/c1-7-13(19)9(5-18)10(6-29-30(20,21)22)14(15-7)17-16-11-3-2-8(31(23,24)25)4-12(11)32(26,27)28/h2-5,19H,6H2,1H3,(H2,20,21,22)(H,23,24,25)(H,26,27,28) PNFZSRRRZNXSMF-UHFFFAOYSA-N 85043 CAS_149017-66-3::CHEMBL69234::NSC_6093163::PPADS P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=85043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=85043&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5478935 136351143 CHEMBL69234 ZINC18247107 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807038 CSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2n1 InChI=1S/C11H18N5O13P3S/c1-33-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(27-10)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1 XNOBOKJVOTYSJV-KQYNXXCUSA-N 50118232 2-MeSATP::ATP, 2-meS::CHEMBL336208 P2X purinoceptor 4 Rattus 7400 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118232&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 6AT 5SVP,5SVM,4PY0 5310983 104011569 CHEMBL336208 C03517 ZINC17654543 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807065 CNc1ncnc2n(cnc12)[C@H]1C[C@H](OP(O)(O)=O)[C@@H](COP(O)(O)=O)O1 InChI=1S/C11H17N5O9P2/c1-12-10-9-11(14-4-13-10)16(5-15-9)8-2-6(25-27(20,21)22)7(24-8)3-23-26(17,18)19/h4-8H,2-3H2,1H3,(H,12,13,14)(H2,17,18,19)(H2,20,21,22)/t6-,7+,8+/m0/s1 CCPLITQNIFLYQB-XLPZGREQSA-N 50118229 CHEMBL129841::MRS 2179 P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118229&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5311303 104011566 CHEMBL129841 ZINC03985980 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807072 Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 XTWYTFMLZFPYCI-KQYNXXCUSA-N 50368125 ADENOSINE DIPHOSPHATE::ADP P2X purinoceptor 4 Rattus 28000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368125&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search ADP 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6022 160847227 16761 C03517 ZINC67267160 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807107 Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)CP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O InChI=1S/C11H18N5O12P3/c12-9-6-10(14-2-13-9)16(3-15-6)11-8(18)7(17)5(27-11)1-26-29(19,20)4-30(21,22)28-31(23,24)25/h2-3,5,7-8,11,17-18H,1,4H2,(H,19,20)(H,21,22)(H2,12,13,14)(H2,23,24,25)/t5-,7-,8-,11-/m1/s1 CAWZRIXWFRFUQB-IOSLPCCCSA-N 50118221 9H-purine derivative::CHEMBL132722::DIPHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER::alpha,beta-meATP P2X purinoceptor 4 Rattus 33000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118221&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91557 104011558 35056 CHEMBL132722 4093 C13740 ZINC08295117 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50807035 CCCCCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)c2n1 InChI=1S/C16H26N5O7PS/c1-2-3-4-5-6-30-16-19-13(17)10-14(20-16)21(8-18-10)15-12(23)11(22)9(28-15)7-27-29(24,25)26/h8-9,11-12,15,22-23H,2-7H2,1H3,(H2,17,19,20)(H2,24,25,26)/t9-,11-,12-,15-/m1/s1 MSDFWMVEFNRURX-SDBHATRESA-N 50118240 ((2R,3S,4R,5R)-5-(6-amino-2-(hexylthio)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate::CHEMBL130094::HT-AMP P2X purinoceptor 4 Rattus 20000 ChEMBL 10.1021/jm020046y 10.7270/Q2VX0H71 12213051 Jacobson, KA; Jarvis, MF; Williams, M National Institute of Diabetes http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118240&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5310949 104011577 CHEMBL130094 ZINC13557426 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921081 Cc1c(N)cccc1Nc1cc(c(N)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H17N3O5S/c1-10-13(22)7-4-8-14(10)24-15-9-16(30(27,28)29)19(23)18-17(15)20(25)11-5-2-3-6-12(11)21(18)26/h2-9,24H,22-23H2,1H3,(H,27,28,29)/p-1 XQZIGJUSTMFPML-UHFFFAOYSA-M 50336780 CHEMBL1672103::sodium 1-amino-4-(3-amino-2-methylphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336780&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448185 125086882 CHEMBL1672103 ZINC59746052 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921082 Nc1c(cc(Nc2ccc(c(Nc3nc(Cl)nc(Cl)n3)c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C23H14Cl2N6O8S2/c24-21-29-22(25)31-23(30-21)28-12-7-9(5-6-14(12)40(34,35)36)27-13-8-15(41(37,38)39)18(26)17-16(13)19(32)10-3-1-2-4-11(10)20(17)33/h1-8,27H,26H2,(H,34,35,36)(H,37,38,39)(H,28,29,30,31)/p-2 RTLULCVBFCRQKI-UHFFFAOYSA-L 50336781 CHEMBL1672104::Disodium 1-Amino-4-[3-(4,6-dichloro[1,3,5]triazine-2-ylamino)-4-sulfophenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336781&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 45100265 125086883 CHEMBL1672104 ZINC06830021 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921083 Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Cl)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C23H14Cl2N6O8S2/c24-21-29-22(25)31-23(30-21)28-12-6-5-9(7-14(12)40(34,35)36)27-13-8-15(41(37,38)39)18(26)17-16(13)19(32)10-3-1-2-4-11(10)20(17)33/h1-8,27H,26H2,(H,34,35,36)(H,37,38,39)(H,28,29,30,31)/p-2 WMMDLLKMVKWKIP-UHFFFAOYSA-L 50118218 CHEMBL131271::Disodium 1-amino-4-[4-(4,6-dichloro-[1,3,5]triazine-2-ylamino)-3-sulfophenylamino]-9,10-dioxo-9,10-di-hydroanthracene-2-sulfonate::MG 40-1 P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118218&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932053 104011555 CHEMBL131271 ZINC27328433 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921084 Nc1c(cc(Nc2ccc(Nc3ncccn3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C24H17N5O8S2/c25-21-18(39(35,36)37)11-16(19-20(21)23(31)14-5-2-1-4-13(14)22(19)30)28-12-6-7-15(17(10-12)38(32,33)34)29-24-26-8-3-9-27-24/h1-11,28H,25H2,(H,26,27,29)(H,32,33,34)(H,35,36,37)/p-2 ZIFQNSIXEIWWPD-UHFFFAOYSA-L 50268965 CHEMBL499428::Disodium 1-amino-4-[4-([1,3]diazine-2-ylamino)-3-sulfophenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268965&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935144 104115071 CHEMBL499428 ZINC49889003 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921085 Nc1c(cc(Nc2cc(Nc3nc(Cl)nc(Cl)n3)cc(c2)C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C24H14Cl2N6O7S/c25-22-30-23(26)32-24(31-22)29-11-6-9(21(35)36)5-10(7-11)28-14-8-15(40(37,38)39)18(27)17-16(14)19(33)12-3-1-2-4-13(12)20(17)34/h1-8,28H,27H2,(H,35,36)(H,37,38,39)(H,29,30,31,32)/p-1 WNDJATPAYNDPLE-UHFFFAOYSA-M 50268874 CHEMBL499580::Sodium 1-Amino-4-[3-(4,6-dichloro-[1,3,5]triazine-2-ylamino)-5-carboxyphenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268874 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268874&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935135 104115032 CHEMBL499580 ZINC49888955 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921086 Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Cl)n3)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C23H14Cl2N6O5S/c24-21-29-22(25)31-23(30-21)28-11-7-5-10(6-8-11)27-14-9-15(37(34,35)36)18(26)17-16(14)19(32)12-3-1-2-4-13(12)20(17)33/h1-9,27H,26H2,(H,34,35,36)(H,28,29,30,31)/p-1 UIPXJMQJSGBYIZ-UHFFFAOYSA-M 50268875 CHEMBL496401::Sodium 1-amino-4-[4-(4,6-dichloro-[1,3,5]triazine-2-ylamino)-phenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268875 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268875&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935136 104115033 CHEMBL496401 ZINC49888706 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921088 Nc1c(cc(Nc2ccc(Nc3ncccn3)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C24H17N5O5S/c25-21-18(35(32,33)34)12-17(19-20(21)23(31)16-5-2-1-4-15(16)22(19)30)28-13-6-8-14(9-7-13)29-24-26-10-3-11-27-24/h1-12,28H,25H2,(H,26,27,29)(H,32,33,34)/p-1 HWUXQFIHYGVOIL-UHFFFAOYSA-M 50268966 CHEMBL496229::Sodium 1-Amino-4-[4-([1,3]diazine-2-ylamino)phenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268966&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935145 104115072 CHEMBL496229 ZINC40957781 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921089 COc1nc(Cl)nc(Nc2ccc(Nc3cc(c(N)c4C(=O)c5ccccc5C(=O)c34)S([O-])(=O)=O)cc2S([O-])(=O)=O)n1 InChI=1S/C24H17ClN6O9S2/c1-40-24-30-22(25)29-23(31-24)28-13-7-6-10(8-15(13)41(34,35)36)27-14-9-16(42(37,38)39)19(26)18-17(14)20(32)11-4-2-3-5-12(11)21(18)33/h2-9,27H,26H2,1H3,(H,34,35,36)(H,37,38,39)(H,28,29,30,31)/p-2 MQIWIMRDOFFCID-UHFFFAOYSA-L 50268876 CHEMBL509572::Disodium 1-amino-4-[4-(4-chloro-6-methoxy-[1,3,5]triazine-2-ylamino)-3-sulfophenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268876 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268876&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935137 104115034 CHEMBL509572 ZINC49899400 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921090 Nc1c(cc(Nc2ccc(Nc3nc(=O)[nH]c(=O)[nH]3)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C23H16N6O7S/c24-18-15(37(34,35)36)9-14(16-17(18)20(31)13-4-2-1-3-12(13)19(16)30)25-10-5-7-11(8-6-10)26-21-27-22(32)29-23(33)28-21/h1-9,25H,24H2,(H,34,35,36)(H3,26,27,28,29,32,33)/p-1 SUBUVWLVTJOKQD-UHFFFAOYSA-M 50336782 CHEMBL1672106::Sodium 1-Amino-4-[4-(4,6-dihydroxy[1,3,5]triazine-2-ylamino)-phenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336782&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932496 125086884 CHEMBL1672106 ZINC66076903 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921091 Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4ccccc4S([O-])(=O)=O)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-16-7-3-4-8-19(16)49(40,41)42)37-29(36-27)34-17-10-9-13(11-20(17)50(43,44)45)32-18-12-21(51(46,47)48)24(31)23-22(18)25(38)14-5-1-2-6-15(14)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/p-3 YKCWQPZFAFZLBI-UHFFFAOYSA-K 50118231 CHEMBL134193::Cibachron Blue 3GA P2X purinoceptor 4 Rattus 40000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118231&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 25202365 104011568 CHEMBL134193 ZINC85427635 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921157 Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccccc2)cc1S([O-])(=O)=O InChI=1S/C20H14N2O5S/c21-18-15(28(25,26)27)10-14(22-11-6-2-1-3-7-11)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h1-10,22H,21H2,(H,25,26,27)/p-1 OPBOOIFXQHPAPJ-UHFFFAOYSA-M 50227032 CHEMBL256057::acid blue 25::sodium 1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50227032 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50227032&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 7072970 104097288 CHEMBL256057 ZINC04016164 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921158 Cc1cc(Nc2ccccc2)c2C(=O)c3ccccc3C(=O)c2c1N InChI=1S/C21H16N2O2/c1-12-11-16(23-13-7-3-2-4-8-13)17-18(19(12)22)21(25)15-10-6-5-9-14(15)20(17)24/h2-11,23H,22H2,1H3 LMPJWWHQFZECNH-UHFFFAOYSA-N 50336783 1-amino-2-methyl-4-(phenylamino)anthracene-9,10-dione::CHEMBL596985 P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336783&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 46228549 125086885 CHEMBL596985 ZINC45365987 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921159 Cc1cccc(Nc2cc(C)c(N)c3C(=O)c4ccccc4C(=O)c23)c1 InChI=1S/C22H18N2O2/c1-12-6-5-7-14(10-12)24-17-11-13(2)20(23)19-18(17)21(25)15-8-3-4-9-16(15)22(19)26/h3-11,24H,23H2,1-2H3 XIHYKDLGZJGNNS-UHFFFAOYSA-N 50336784 1-amino-2-methyl-4-(m-tolylamino)anthracene-9,10-dione::CHEMBL1671991 P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336784&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 20705288 125086886 CHEMBL1671991 ZINC66077324 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921160 Nc1c(cc(NC2CCCCC2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H20N2O5S/c21-18-15(28(25,26)27)10-14(22-11-6-2-1-3-7-11)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h4-5,8-11,22H,1-3,6-7,21H2,(H,25,26,27)/p-1 GMBNNHLANOGOAU-UHFFFAOYSA-M 50336785 CHEMBL606414::sodium 1-amino-4-(cyclohexylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336785&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 5079831 125086887 CHEMBL606414 ZINC04533388 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921161 Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2cccc3ccccc23)cc1S([O-])(=O)=O InChI=1S/C24H16N2O5S/c25-22-19(32(29,30)31)12-18(26-17-11-5-7-13-6-1-2-8-14(13)17)20-21(22)24(28)16-10-4-3-9-15(16)23(20)27/h1-12,26H,25H2,(H,29,30,31)/p-1 ZHQRPIRGSWEALJ-UHFFFAOYSA-M 50268574 CHEMBL498423::Sodium 1-Amino-4-(1-naphthylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::Sodium 1-amino-4-[1-naphthylamino]-9,10-dioxo-9,10 dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268574 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268574&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 24868314 104114923 CHEMBL498423 ZINC13831235 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921162 Cc1ccccc1Nc1cc(c(N)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H16N2O5S/c1-11-6-2-5-9-14(11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)12-7-3-4-8-13(12)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 IDRCEVKPWMZGEN-UHFFFAOYSA-M 50336786 CHEMBL256864::sodium 1-amino-9,10-dioxo-4-(o-tolylamino)-9,10-dihydroanthracene-2-sulfonate::sodium 4-(o-toluidino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336786&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932497 125086888 CHEMBL256864 ZINC05161338 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921163 Cc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c1 InChI=1S/C21H16N2O5S/c1-11-5-4-6-12(9-11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)13-7-2-3-8-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 AYMOWRNYHLSUHI-UHFFFAOYSA-M 50336787 CHEMBL445413::sodium 1-amino-9,10-dioxo-4-(m-tolylamino)-9,10-dihydroanthracene-2-sulfonate::sodium 4-(m-toluidino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336787&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932498 125086889 CHEMBL445413 ZINC29131032 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921164 Cc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1 InChI=1S/C21H16N2O5S/c1-11-6-8-12(9-7-11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)13-4-2-3-5-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 BSXYUOSITLGJAD-UHFFFAOYSA-M 50336788 CHEMBL404450::sodium 1-amino-9,10-dioxo-4-(p-tolylamino)-9,10-dihydroanthracene-2-sulfonate::sodium 4-(p-toluidino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336788&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 3362671 125086890 CHEMBL404450 ZINC04044209 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921165 Cc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c1C InChI=1S/C22H18N2O5S/c1-11-6-5-9-15(12(11)2)24-16-10-17(30(27,28)29)20(23)19-18(16)21(25)13-7-3-4-8-14(13)22(19)26/h3-10,24H,23H2,1-2H3,(H,27,28,29)/p-1 KKWWXCGTSPOABZ-UHFFFAOYSA-M 50336791 CHEMBL402239::sodium 1-amino-4-(2,3-dimethylphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336791&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932501 125086893 CHEMBL402239 ZINC29130954 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921166 Cc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c(C)c1 InChI=1S/C22H18N2O5S/c1-11-7-8-15(12(2)9-11)24-16-10-17(30(27,28)29)20(23)19-18(16)21(25)13-5-3-4-6-14(13)22(19)26/h3-10,24H,23H2,1-2H3,(H,27,28,29)/p-1 FYTJTDPRQJFSHH-UHFFFAOYSA-M 50336792 CHEMBL256688::sodium 1-amino-4-(2,4-dimethylphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336792&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932502 125086894 CHEMBL256688 ZINC29130950 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921167 Nc1c(cc(Nc2ccccc2O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H14N2O6S/c21-18-15(29(26,27)28)9-13(22-12-7-3-4-8-14(12)23)16-17(18)20(25)11-6-2-1-5-10(11)19(16)24/h1-9,22-23H,21H2,(H,26,27,28)/p-1 PPOIMBFKMLPDFQ-UHFFFAOYSA-M 50268687 CHEMBL522725::sodium 1-amino-4-(2-hydroxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268687&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448174 104114973 CHEMBL522725 ZINC40972433 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921168 Nc1c(cc(Nc2ccc(O)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H14N2O6S/c21-18-15(29(26,27)28)9-14(22-10-5-7-11(23)8-6-10)16-17(18)20(25)13-4-2-1-3-12(13)19(16)24/h1-9,22-23H,21H2,(H,26,27,28)/p-1 KFBGXLCLNATBFL-UHFFFAOYSA-M 50268725 CHEMBL496030::sodium 1-amino-4-(4-hydroxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268725&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448191 104114982 CHEMBL496030 ZINC05162649 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921169 COc1ccccc1Nc1cc(c(N)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H16N2O6S/c1-29-15-9-5-4-8-13(15)23-14-10-16(30(26,27)28)19(22)18-17(14)20(24)11-6-2-3-7-12(11)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 WCRXWKFBJBYISN-UHFFFAOYSA-M 50336767 CHEMBL257495::PSB-716::sodium 1-amino-4-(2-methoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336767&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448190 125086869 CHEMBL257495 ZINC29130857 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921170 COc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c1 InChI=1S/C21H16N2O6S/c1-29-12-6-4-5-11(9-12)23-15-10-16(30(26,27)28)19(22)18-17(15)20(24)13-7-2-3-8-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 UOXSNOOWASRNHS-UHFFFAOYSA-M 50336768 CHEMBL1671995::sodium 1-amino-4-(3-methoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336768&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448192 125086870 CHEMBL1671995 ZINC33606789 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921171 COc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1 InChI=1S/C21H16N2O6S/c1-29-12-8-6-11(7-9-12)23-15-10-16(30(26,27)28)19(22)18-17(15)20(24)13-4-2-3-5-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 MURCBJRRFKMCAT-UHFFFAOYSA-M 50227023 1-amino-4-(4-methoxyphenyl)-2-sulfoanthraquinone::CHEMBL401735::SB-416::sodium 1-amino-4-(4-methoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50227023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50227023&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448176 104097287 CHEMBL401735 ZINC29130859 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921172 CCOc1ccccc1Nc1cc(c(N)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C22H18N2O6S/c1-2-30-16-10-6-5-9-14(16)24-15-11-17(31(27,28)29)20(23)19-18(15)21(25)12-7-3-4-8-13(12)22(19)26/h3-11,24H,2,23H2,1H3,(H,27,28,29)/p-1 GZFYHEVWXRIXES-UHFFFAOYSA-M 50336769 CHEMBL403051::sodium 1-amino-4-(2-ethoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336769&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932493 125086871 CHEMBL403051 ZINC29130851 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921173 Nc1c(cc(Nc2ccc(Oc3ccccc3)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C26H18N2O6S/c27-24-21(35(31,32)33)14-20(22-23(24)26(30)19-9-5-4-8-18(19)25(22)29)28-15-10-12-17(13-11-15)34-16-6-2-1-3-7-16/h1-14,28H,27H2,(H,31,32,33)/p-1 LBWABNLVVJJHCX-UHFFFAOYSA-M 50336770 CHEMBL597203::Sodium 1-amino-4-(4-phenoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-9,10-dioxo-4-(4-phenoxyphenylamino)-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336770&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932494 125086872 CHEMBL597203 ZINC45355160 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921174 Nc1c(cc(Nc2ccc(F)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H13FN2O5S/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25/h1-9,23H,22H2,(H,26,27,28)/p-1 HCTWKQCCDOTHIE-UHFFFAOYSA-M 50336771 CHEMBL604158::sodium 1-amino-4-(4-fluorophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336771&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448182 125086873 CHEMBL604158 ZINC45392019 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921175 Nc1c(cc(Nc2cccc(Br)c2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H13BrN2O5S/c21-10-4-3-5-11(8-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-6-1-2-7-13(12)20(17)25/h1-9,23H,22H2,(H,26,27,28)/p-1 HTYPARFZJKMPJI-UHFFFAOYSA-M 50336772 CHEMBL1672098::sodium 1-amino-4-(3-bromophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336772&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448173 125086874 CHEMBL1672098 ZINC66066274 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921176 Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccccc2S([O-])(=O)=O)cc1S([O-])(=O)=O InChI=1S/C20H14N2O8S2/c21-18-15(32(28,29)30)9-13(22-12-7-3-4-8-14(12)31(25,26)27)16-17(18)20(24)11-6-2-1-5-10(11)19(16)23/h1-9,22H,21H2,(H,25,26,27)(H,28,29,30)/p-2 DEMVYVPKDYOXHF-UHFFFAOYSA-L 50336773 CHEMBL597590::sodium 1-amino-9,10-dioxo-4-(2-sulfonatophenylamino)-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-9,10-dioxo-4-(2-sulfophenylamino)-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336773&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448181 125086875 CHEMBL597590 ZINC35937254 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921177 Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccc(cc2)S([O-])(=O)=O)cc1S([O-])(=O)=O InChI=1S/C20H14N2O8S2/c21-18-15(32(28,29)30)9-14(22-10-5-7-11(8-6-10)31(25,26)27)16-17(18)20(24)13-4-2-1-3-12(13)19(16)23/h1-9,22H,21H2,(H,25,26,27)(H,28,29,30)/p-2 FRCFIFJAGOXKPG-UHFFFAOYSA-L 50268686 CHEMBL496022::sodium 1-amino-9,10-dioxo-4-(4-sulfonatophenylamino)-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-9,10-dioxo-4-(4-sulfophenylamino)-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268686&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448169 104114972 CHEMBL496022 ZINC40972431 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921178 Nc1c(cc(Nc2ccccc2C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H14N2O7S/c22-18-15(31(28,29)30)9-14(23-13-8-4-3-7-12(13)21(26)27)16-17(18)20(25)11-6-2-1-5-10(11)19(16)24/h1-9,23H,22H2,(H,26,27)(H,28,29,30)/p-1 CRGRFFSHCCZVQW-UHFFFAOYSA-M 50268685 CHEMBL524064::sodium 1-amino-4-(2-carboxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268685&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448159 104114971 CHEMBL524064 ZINC40953702 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921179 Nc1c(cc(Nc2cccc(c2)C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H14N2O7S/c22-18-15(31(28,29)30)9-14(23-11-5-3-4-10(8-11)21(26)27)16-17(18)20(25)13-7-2-1-6-12(13)19(16)24/h1-9,23H,22H2,(H,26,27)(H,28,29,30)/p-1 DNGXTKJLUVIIRF-UHFFFAOYSA-M 50336774 CHEMBL598857::sodium 1-amino-4-(3-carboxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336774&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448172 125086876 CHEMBL598857 ZINC13509468 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921180 Nc1c(cc(Nc2ccc(cc2)C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H14N2O7S/c22-18-15(31(28,29)30)9-14(23-11-7-5-10(6-8-11)21(26)27)16-17(18)20(25)13-4-2-1-3-12(13)19(16)24/h1-9,23H,22H2,(H,26,27)(H,28,29,30)/p-1 QNQAEGCXDAVKAX-UHFFFAOYSA-M 50336775 CHEMBL604300::sodium 1-amino-4-(4-carboxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336775&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448175 125086877 CHEMBL604300 ZINC45389821 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921181 Nc1ccccc1Nc1cc(c(N)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C20H15N3O5S/c21-12-7-3-4-8-13(12)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)10-5-1-2-6-11(10)20(17)25/h1-9,23H,21-22H2,(H,26,27,28)/p-1 PCAZMSPKYQQSFO-UHFFFAOYSA-M 50268635 CHEMBL450832::sodium 1-amino-4-(2-aminophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268635 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268635&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448162 104114951 CHEMBL450832 ZINC40836180 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921182 Nc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c1 InChI=1S/C20H15N3O5S/c21-10-4-3-5-11(8-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-6-1-2-7-13(12)20(17)25/h1-9,23H,21-22H2,(H,26,27,28)/p-1 LQUCSXOZWDCBQC-UHFFFAOYSA-M 50336776 CHEMBL597820::sodium 1-amino-4-(3-aminophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336776&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448161 125086878 CHEMBL597820 ZINC04824621 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921183 Nc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1 InChI=1S/C20H15N3O5S/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25/h1-9,23H,21-22H2,(H,26,27,28)/p-1 ZCQMYMXRGJWSHH-UHFFFAOYSA-M 50268636 1-amino-4-(4-aminophenylamino)-9,10-dioxo-9,10-dihydroanthracene 2-sulfonic acid sodium salt::CHEMBL496012::Sodium 1-Amino-4-(4-aminophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268636&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448157 104114952 CHEMBL496012 ZINC04824612 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921184 CC(=O)Nc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1 InChI=1S/C22H17N3O6S/c1-11(26)24-12-6-8-13(9-7-12)25-16-10-17(32(29,30)31)20(23)19-18(16)21(27)14-4-2-3-5-15(14)22(19)28/h2-10,25H,23H2,1H3,(H,24,26)(H,29,30,31)/p-1 CKDSSRXGNPFPPZ-UHFFFAOYSA-M 50227015 CHEMBL271688::Sodium 1-amino-4-(4-acetylaminophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::sodium 4-(4-acetamidophenylamino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50227015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50227015&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 4596413 104097282 CHEMBL271688 ZINC05487265 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921185 Nc1c(cc(Nc2ccc(Cl)cc2C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H13ClN2O7S/c22-9-5-6-13(12(7-9)21(27)28)24-14-8-15(32(29,30)31)18(23)17-16(14)19(25)10-3-1-2-4-11(10)20(17)26/h1-8,24H,23H2,(H,27,28)(H,29,30,31)/p-1 AWDHCCPCIMVLNR-UHFFFAOYSA-M 50268767 CHEMBL524284::sodium 1-amino-4-(2-carboxy-4-chlorophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268767&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448155 104114998 CHEMBL524284 ZINC04016165 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921186 Nc1c(cc(Nc2cc(Cl)ccc2C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H13ClN2O7S/c22-9-5-6-12(21(27)28)13(7-9)24-14-8-15(32(29,30)31)18(23)17-16(14)19(25)10-3-1-2-4-11(10)20(17)26/h1-8,24H,23H2,(H,27,28)(H,29,30,31)/p-1 ROOPBYWMELIWRC-UHFFFAOYSA-M 50268768 CHEMBL522053::sodium 1-amino-4-(2-carboxy-5-chlorophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268768&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448156 104114999 CHEMBL522053 ZINC35300295 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921187 Nc1cc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)ccc1S([O-])(=O)=O InChI=1S/C20H15N3O8S2/c21-12-7-9(5-6-14(12)32(26,27)28)23-13-8-15(33(29,30)31)18(22)17-16(13)19(24)10-3-1-2-4-11(10)20(17)25/h1-8,23H,21-22H2,(H,26,27,28)(H,29,30,31)/p-2 ZOHPJXCEVYGLJT-UHFFFAOYSA-L 50268726 CHEMBL521709::Disodium 1-amino-4-(3-amino-4-sulfophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-4-(3-amino-4-sulfophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268726&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935127 104114983 CHEMBL521709 ZINC31291954 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921188 Nc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1S([O-])(=O)=O InChI=1S/C20H15N3O8S2/c21-12-6-5-9(7-14(12)32(26,27)28)23-13-8-15(33(29,30)31)18(22)17-16(13)19(24)10-3-1-2-4-11(10)20(17)25/h1-8,23H,21-22H2,(H,26,27,28)(H,29,30,31)/p-2 VZKVROOYNMPMLU-UHFFFAOYSA-L 50268727 CHEMBL495834::Disodium 1-amino-4-(4-amino-3-sulfophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-4-(4-amino-3-sulfophenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268727&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935128 104114984 CHEMBL495834 ZINC03873984 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921189 Nc1cc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc(c1)C(O)=O InChI=1S/C21H15N3O7S/c22-10-5-9(21(27)28)6-11(7-10)24-14-8-15(32(29,30)31)18(23)17-16(14)19(25)12-3-1-2-4-13(12)20(17)26/h1-8,24H,22-23H2,(H,27,28)(H,29,30,31)/p-1 ADIFFDVVLPNKRZ-UHFFFAOYSA-M 50268765 CHEMBL498038::sodium 1-amino-4-(3-amino-5-carboxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268765&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448167 104114996 CHEMBL498038 ZINC40431006 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921190 Cc1cc(C)c(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c(C)c1 InChI=1S/C23H20N2O5S/c1-11-8-12(2)21(13(3)9-11)25-16-10-17(31(28,29)30)20(24)19-18(16)22(26)14-6-4-5-7-15(14)23(19)27/h4-10,25H,24H2,1-3H3,(H,28,29,30)/p-1 YKHGPGKCMQFZSK-UHFFFAOYSA-M 50118211 Acid Blue 129::CHEMBL133576::cid_23675739::sodium 1-amino-4-(mesitylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118211&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 3863984 104011548 CHEMBL133576 ZINC03879185 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921191 Cc1cc(C)c(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c(C)c1N InChI=1S/C23H21N3O5S/c1-10-8-11(2)21(12(3)19(10)24)26-15-9-16(32(29,30)31)20(25)18-17(15)22(27)13-6-4-5-7-14(13)23(18)28/h4-9,26H,24-25H2,1-3H3,(H,29,30,31)/p-1 WBHUKLABQDSNEC-UHFFFAOYSA-M 50268873 CHEMBL495796::Sodium 1-amino-4-(3-amino-2,4,6-trimethylphenylamino)-9,10-dioxo-9,10-dihydro anthracene-2-sulfonate::Sodium 1-amino-4-(3-amino-2,4,6-trimethylphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268873 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268873&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91935134 104115031 CHEMBL495796 ZINC40429384 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921192 Nc1c(cc(Nc2ccc(CC(O)=O)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C22H16N2O7S/c23-20-16(32(29,30)31)10-15(24-12-7-5-11(6-8-12)9-17(25)26)18-19(20)22(28)14-4-2-1-3-13(14)21(18)27/h1-8,10,24H,9,23H2,(H,25,26)(H,29,30,31)/p-1 MVALFVXXRAJWLG-UHFFFAOYSA-M 50336777 CHEMBL597591::sodium 1-amino-4-(4-(carboxymethyl)phenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336777&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448183 125086879 CHEMBL597591 C03768 ZINC45364997 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921193 CCOP(=O)(Cc1ccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)cc1)OCC InChI=1S/C25H25N2O8PS/c1-3-34-36(30,35-4-2)14-15-9-11-16(12-10-15)27-19-13-20(37(31,32)33)23(26)22-21(19)24(28)17-7-5-6-8-18(17)25(22)29/h5-13,27H,3-4,14,26H2,1-2H3,(H,31,32,33)/p-1 KGZAQSFSNUUZRX-UHFFFAOYSA-M 50336778 CHEMBL596982::Sodium 1-amino-4-[4-(diethoxyphosphoryl)methylphenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate::sodium 1-amino-4-(4-((diethoxyphosphoryl)methyl)phenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336778&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91932495 125086880 CHEMBL596982 ZINC49757435 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50921194 Nc1c(cc(Nc2ccc(O)c(c2)C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O InChI=1S/C21H14N2O8S/c22-18-15(32(29,30)31)8-13(23-9-5-6-14(24)12(7-9)21(27)28)16-17(18)20(26)11-4-2-1-3-10(11)19(16)25/h1-8,23-24H,22H2,(H,27,28)(H,29,30,31)/p-1 KSXUGSOTPZRKPL-UHFFFAOYSA-M 50336779 CHEMBL1672102::sodium 1-amino-4-(3-carboxy-4-hydroxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm1012193 10.7270/Q2VH5PTG 21207957 Baqi, Y; Hausmann, R; Rosefort, C; Rettinger, J; Schmalzing, G; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336779&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 59448186 125086881 CHEMBL1672102 ZINC66074009 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973473 OC1(c2ccccc2)c2ccccc2N(Cc2ccccc2)c2ccccc12 InChI=1S/C26H21NO/c28-26(21-13-5-2-6-14-21)22-15-7-9-17-24(22)27(19-20-11-3-1-4-12-20)25-18-10-8-16-23(25)26/h1-18,28H,19H2 PEMLUSSWDFVTHU-UHFFFAOYSA-N 50399190 CHEMBL2180149 P2X purinoceptor 4 Rattus 4040 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399190&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 71459185 163348214 CHEMBL2180149 ZINC95578665 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973474 Cc1ccc(COC(=O)N2c3ccccc3Oc3ccccc23)cc1 InChI=1S/C21H17NO3/c1-15-10-12-16(13-11-15)14-24-21(23)22-17-6-2-4-8-19(17)25-20-9-5-3-7-18(20)22/h2-13H,14H2,1H3 NVOWNIGGPNJGNW-UHFFFAOYSA-N 50399164 CHEMBL2180138 P2X purinoceptor 4 Rattus >10000 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399164 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399164&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 71450180 163348188 CHEMBL2180138 ZINC95580373 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973475 O=C(OCc1ccccc1)N1c2ccccc2Oc2ccccc12 InChI=1S/C20H15NO3/c22-20(23-14-15-8-2-1-3-9-15)21-16-10-4-6-12-18(16)24-19-13-7-5-11-17(19)21/h1-13H,14H2 KGVCOYMLGBNCDW-UHFFFAOYSA-N 50399165 CHEMBL2180137 P2X purinoceptor 4 Rattus 2100 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399165&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 60168729 163348189 CHEMBL2180137 ZINC95578736 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973476 CC(C)OC(=O)N1c2ccccc2Oc2ccccc12 InChI=1S/C16H15NO3/c1-11(2)19-16(18)17-12-7-3-5-9-14(12)20-15-10-6-4-8-13(15)17/h3-11H,1-2H3 USSSANRHRXBTLY-UHFFFAOYSA-N 50399166 CHEMBL2180136 P2X purinoceptor 4 Rattus 6080 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399166 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399166&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 71462707 163348190 CHEMBL2180136 ZINC95573322 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973477 Cc1ccc(cc1)S(=O)(=O)N1c2ccccc2Oc2ccccc12 InChI=1S/C19H15NO3S/c1-14-10-12-15(13-11-14)24(21,22)20-16-6-2-4-8-18(16)23-19-9-5-3-7-17(19)20/h2-13H,1H3 DHZNMEIBMACSFH-UHFFFAOYSA-N 50399183 CHEMBL2180160 P2X purinoceptor 4 Rattus 928 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399183&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 2320735 163348207 CHEMBL2180160 ZINC03191166 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973478 Fc1ccc(cc1)[C@@H]1CCNC[C@H]1COc1ccc2OCOc2c1 InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1 AHOUBRCZNHFOSL-YOEHRIQHSA-N 22416 (3S,4R)-3-[(1,3-benzodioxol-5-yloxy)methyl]-4-(4-fluorophenyl)piperidine::(3S,4R)-3-[(2H-1,3-benzodioxol-5-yloxy)methyl]-4-(4-fluorophenyl)piperidine::CHEMBL490::PAROXETINE::US09969700, Paroxetine::US9944618, Compound ID No. 182::[3H]Paroxetine P2X purinoceptor 4 Rattus 2450 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=22416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=22416&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 8PR 6F6I,7OIH,6DZW,6AWN,4JLT,3V5W,4MM4,6VRH,5I6X,4L9I 43815 49846231 7936 CHEMBL490 DB00715 4561 C07415 ZINC00527386 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973479 Nc1ncnc2n(cnc12)C1OC(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)C2OC3(OC12)C(=C[C-](C=C3[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O InChI=1S/C16H16N8O19P3/c17-13-10-14(19-4-18-13)21(5-20-10)15-12-11(7(39-15)3-38-45(34,35)43-46(36,37)42-44(31,32)33)40-16(41-12)8(23(27)28)1-6(22(25)26)2-9(16)24(29)30/h1-2,4-5,7,11-12,15H,3H2,(H,34,35)(H,36,37)(H2,17,18,19)(H2,31,32,33)/q-1 SRBOSGVHTINDAV-UHFFFAOYSA-N 50370141 TNP-ATP P2X purinoceptor 4 Rattus 4710 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50370141 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50370141&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 4468924 160849243 C03517 ZINC87515504 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973480 CSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2n1 InChI=1S/C11H18N5O13P3S/c1-33-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(27-10)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1 XNOBOKJVOTYSJV-KQYNXXCUSA-N 50118232 2-MeSATP::ATP, 2-meS::CHEMBL336208 P2X purinoceptor 4 Rattus 10000 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118232&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 6AT 5SVP,5SVM,4PY0 5310983 104011569 CHEMBL336208 C03517 ZINC17654543 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 50973481 Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 ZKHQWZAMYRWXGA-KQYNXXCUSA-N 50366480 ADENOSINE TRIPHOSPHATE::ATP P2X purinoceptor 4 Rattus 1000 ChEMBL 10.1021/jm300845v 10.7270/Q2XK8GPN 23075067 Hernandez-Olmos, V; Abdelrahman, A; El-Tayeb, A; Freudendahl, D; Weinhausen, S; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50366480 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50366480&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search ATP 7UT9,1Y64,7LNU,7LN3,7LN2,7LN1,7LN0,7LN6,7LN5,7LN4,1NGE,1NGF,1NGG,1NGH,3LTA,3LTC,2NPI,2ZDQ,7NHL,1GY3,6J18,6J17,1G3I,7SGL,2BU2,2Q7G,2BUP,3H8V,6GFA,7QI6,7QI4,1H8H,4AUI,1FMW,1XDP,7ZSE,3O8L,5HNV,7ABR,3EHG,1KAZ,1KAY,1KAX,7R31,7U6Y,6TAY,6TAX,6DDZ,1XMI,1XMJ,6E0O,4A8M,4A8F,4A8Y,4A8Q,4A8S,4A8W,7JIJ,7CRC,7EKL,8H99,7N30,7N31,6YWX,6YWY,6YWE,6YW6,6YW7,6YW5,4B2Q,2W5G,2W5I,3HBT,8DAR,3CQD,4QC2,1Q97,4GY2,6FU2,1E4G,3FFK,3JZM,4CI6,1MO8,4QNR,6D3S,6D3R,7P2E,7P2Y,7V2Z,5ECQ,5ECP,4XWO,4XW5,2VHT,2VHQ,6NHX,6NHZ,6KCL,6KCM,6KC0,7JM6,7JM7,6MT9,1U5R,1I7L,1OL6,6JRS,7D4O,7D4U,7T3U,1ZAO,1Q24,6ZQM,3A5N,1PJ4,7AI5,3TPQ,7C1Z,4Q4Z,1B0U,7OQH,7LJ1,6P8J,3DGO,6ZO4,5FV0,6L59,6L57,4X6R,3R1R,7PX9,7U9X,7WTD,7WTE,7U9T,7U9K,2BBT,2BBS,2BBO,6ZTQ,4O0M,6GFH,1JKN,7NGF,7MJP,7MJQ,7MJO,1UF9,5AFU,7KSM,6UDQ,6RKE,6RKD,6RKA,7VVY,7VVZ,1KVK,4H4K,7OZ1,2OLQ,2OLR,7UUX,1NMD,1NM1,3Q60,7OIK,3BG5,3E1Y,7CGN,4GP7,1RDQ,2Q97,6ZYW,6ZYY,7W79,4DX2,3WVL,1SVM,3WV9,4DXL,6Z3R,6IUB,6IUC,5N9X,1HLU,7VLR,3JAY,6QRI,6QDV,3V2U,7AT1,7L1R,7L1S,7L1Q,6S47,6N30,7AM2,6OA9,7YFP,7YFN,7S61,7S67,7Y38,7RFH,7RFE,7RFG,6O75,6O78,1P8Z,6PTN,6PTO,7WPM,5FL7,3QUO,3QUN,4AZW,6YAR,6YAY,1G21,7EV2,7EV3,7M74,2BTF,3REP,3REU,8FHN,8FHO,7AIR,7AIQ,7AIP,3W1G,4TL7,1HCK,6HZM,7DC8,7RNR,4WTV,1AQ2,6N2Y,1NSF,1NSY,2CG9,7JGR,7JGA,5CYR,1YXQ,7FDV,7WAJ,6AB0,6AB2,6AB8,6ABK,3H5N,6YT3,6W18,6W17,6W1Z,7NZ0,7NZ3,1UEV,3T0Z,2F43,2QUI,7ZH9,8BI0,1E79,5U03,4TQD,7PO3,7RES,6CMW,2Z1U,7UJP,7UJT,7P3F,7P3N,4WAE,1TFW,1A0I,1DEJ,4M3Y,4XVU,6NOO,6NOP,6NO7,3UMP,3UMO,5J1T,8ESC,4EAJ,4EAK,4EAH,4EAG,7RAV,3G6V,6KSH,8E9B,1R9T,7MD2,6AEC,3NCQ,3MN6,3MN7,3MN5,3MN9,3UQE,3UQD,5WC0,6SYT,5WCB,4H0T,4H0V,4H0X,4H0Y,4H03,1PK8,7WYX,2FSG,7BT2,7WPT,7WPX,7WPN,7WPL,8DAV,3EQB,8CVT,4KH0,2PAV,2PAA,5EOU,5OTR,2O0H,6PAO,6PAN,6PAQ,5XVU,5FWP,5FWK,5FWL,5FWM,7CM9,7K3Z,4UP9,1TID,7Z5J,1RFQ,6ZSP,5JRJ,5LVP,5D15,6GRG,7MI6,7MI3,3SJH,2AQX,4Z94,6RJ4,3TLX,4O4F,4O4E,4O4D,7W1Y,4AN3,4KGM,4KGV,2PZE,2PZF,2PZG,3Q53,3LKI,3LKK,6PZ9,4XHO,6PZA,6PZI,7NK7,7CFI,3QO3,3QO7,7NZM,7EER,5YA1,6JD4,6JD5,5IE2,6ZXF,6ZXG,6ZXH,8DAS,8DAT,1SU2,3WQU,7QBA,5DRD,5DR2,7QO6,2R9V,4FO0,7V00,6N2Z,4FWM,1Y8R,1Y8P,1Y8Q,7KO2,7LHT,7LHW,1NYR,6BHU,6TQE,4M3T,4M3U,4M3W,4M3R,4M3X,4M3Z,2P55,1IJJ,5YZG,6JIU,6JIY,6JII,6JI0,6ZM6,6ZM5,5O5W,1F9A,8AAZ,4DLK,7QO5,7QO4,7B93,7M6L,7PW7,7M6A,7DYI,7DYE,7K2T,3C9R,1MDU,1KO5,3PGK,4AT8,4AT1,1XKV,8G8F,5XMI,5XMK,1Z0S,7VX8,7N1P,1RYR,1RYS,4FF3,6W23,6W22,6W21,6W20,6W24,4FFR,5VQA,4BJR,8DGC,4F93,6X2N,5ZTB,7R8E,7XA9,3FDX,1MIW,2Z08,2Z02,6CN2,7UIR,7P48,4KR7,3PJR,7PJI,2HMP,2HMU,2HMW,5EXY,4U07,4U0M,1WUA,7SHM,5ECK,5ECI,5ECH,5ECN,7Q6I,5LIL,7Q6F,7Q6D,3ULE,4KB6,7RGQ,6VOM,6VOL,6VOO,6VON,6VOI,6VOH,6VOK,6VOJ,6VOG,6VOF,3DKC,2GNK,3MMV,7LJF,2WPD,5V2L,5XZ9,1PHK,6O1V,7VAL,8A5P,8A5Q,1QZ5,1QZ6,3EPS,5LUH,4XBR,7PUP,7PUB,1YP3,6MAT,5X9G,5X9H,7P3W,8EOP,1LHR,1RGI,6ZR2,7WIT,3A7H,1L2T,6VTD,6VTB,7TVE,5I9E,4DQW,3CI1,3CI5,3CI4,3CIP,3CIS,6AH5,6AH4,2A84,7RZY,6RIS,6RIQ,4ZS4,2IA6,2IAJ,3ZS7,3LL3,4M9Z,4M9X,4M9Y,4M9S,7T0V,5LVO,8BX8,1MB9,2YXU,3QNO,3AB8,7ESB,2Y27,6JCU,2C01,7TCH,2C96,6Z1P,6R4S,7KL1,1ZYD,7PLJ,3M9O,4RTF,2XCW,3V01,3V04,2R86,2ILY,1N48,7W3M,7W3B,7LI3,7LI4,3Q9L,1R8B,5DK4,7U2X,2X15,5I4N,4P33,5YUD,6JH6,6JH8,6JH9,6U0M,8DGF,6IFR,2FGH,3W3D,7RL0,1ASZ,6CTA,3IQ0,4WH3,5GQL,5GQJ,8BD6,8BD4,8BD5,6TE0,4V02,4V0U,3GQK,1FQ1,6HBU,3QX9,3QXC,1U9I,5CSH,4TU0,2W00,2W02,3U8X,4ZGN,7NXV,2FF3,7K58,5T0G,5T0C,5T0J,5T0I,4GT3,7K5B,6FZB,4RQV,5ZUA,5U2H,7WIW,6RDW,7OIM,5A9P,1B8A,5A99,5A98,3X2W,3X2V,3X2U,6COM,7P5Z,7P52,7P50,2PNN,4XTR,4U1R,7ZZ3,7ZZ4,4A6X,4CBX,4CBU,4CBW,4CB0,3UC5,8FZQ,7D7Y,2RSF,6P8V,5KOY,6P80,3FPB,6EMA,2EWW,4G5Y,7ORJ,7ORK,7ORN,1B38,1B39,5Z68,5Z6R,7SXO,2PC9,7UO7,7PVN,1V1B,5L9N,3KE5,3KEU,4FXF,7NJL,7NJO,7NJN,7NJK,7NJQ,7NJS,6ZQN,5XJC,3DGL,2QKM,2QK4,2GBL,3SL2,6FML,7KZU,7KZI,5ACK,3CHW,5MWL,5MW8,5H67,5GJC,8BWY,3M3N,4HUT,7RCK,2ZHZ,7PSA,6WA8,6OIF,2OOY,4M63,7LG5,7LGQ,7LGM,6TDU,6TDY,3LMI,7JPS,7JPR,7JPQ,7JPP,7JPO,7JPN,6AWH,6AWG,4JYZ,5LXQ,6YII,6MM2,4CT2,4CT1,7T65,4CTA,6JBJ,6JBK,6JBD,3QB0,7Z3O,4IFE,3J2T,6IP2,7N74,5SVK,2A42,2A41,2A40,5OBJ,5NBN,5NBM,5NBL,1AYL,7VX0,7N6I,1KXP,1N5I,1N56,6N0T,7LJL,1V3S,7U1E,7U1S,7U1Q,2X0Q,3U9D,6AZ0,5CE3,1TQP,8APF,6JWY,6JWQ,6JWS,6JWT,6JWW,6JWV,5D4C,2XSZ,6U1D,6U1E,6U1F 5957 160845582 15422 C03517 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089263 CC(C)N(C(C)C)C(=O)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C21H24N2O/c1-15(2)22(16(3)4)21(24)23-19-11-7-5-9-17(19)13-14-18-10-6-8-12-20(18)23/h5-16H,1-4H3 DZYRUGGUQGFZDF-UHFFFAOYSA-N 50446060 CHEMBL3103385 P2X purinoceptor 4 Rattus 54600 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446060 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446060&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 73669299 194943956 CHEMBL3103385 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089264 CCCN(CCC)C(=O)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C21H24N2O/c1-3-15-22(16-4-2)21(24)23-19-11-7-5-9-17(19)13-14-18-10-6-8-12-20(18)23/h5-14H,3-4,15-16H2,1-2H3 IAXQJFHTWQFLLJ-UHFFFAOYSA-N 50446068 CHEMBL3103375 P2X purinoceptor 4 Rattus 35900 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446068&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 76324694 194943964 CHEMBL3103375 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089265 O=C(N1CCCC1)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C19H18N2O/c22-19(20-13-5-6-14-20)21-17-9-3-1-7-15(17)11-12-16-8-2-4-10-18(16)21/h1-4,7-12H,5-6,13-14H2 NDGTWBCNSNJJBQ-UHFFFAOYSA-N 50446069 CHEMBL3103372 P2X purinoceptor 4 Rattus 69300 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446069&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 779113 194943965 CHEMBL3103372 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089266 O=C(N1CCCCC1)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C20H20N2O/c23-20(21-14-6-1-7-15-21)22-18-10-4-2-8-16(18)12-13-17-9-3-5-11-19(17)22/h2-5,8-13H,1,6-7,14-15H2 YOBBOVRZEZSALX-UHFFFAOYSA-N 50446070 CHEMBL3103371 P2X purinoceptor 4 Rattus 95800 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446070&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 746996 194943966 CHEMBL3103371 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089267 O=C(NC1CCCCC1)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C21H22N2O/c24-21(22-18-10-2-1-3-11-18)23-19-12-6-4-8-16(19)14-15-17-9-5-7-13-20(17)23/h4-9,12-15,18H,1-3,10-11H2,(H,22,24) DFUGSIMXDLGFTF-UHFFFAOYSA-N 50446072 CHEMBL3103369 P2X purinoceptor 4 Rattus 109000 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446072&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 921624 194943968 CHEMBL3103369 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51089268 CCN(CC)C(=O)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C19H20N2O/c1-3-20(4-2)19(22)21-17-11-7-5-9-15(17)13-14-16-10-6-8-12-18(16)21/h5-14H,3-4H2,1-2H3 TXPHORZRPXNFCG-UHFFFAOYSA-N 50446076 CHEMBL1483754 P2X purinoceptor 4 Rattus 43000 ChEMBL 10.1016/j.bmc.2013.12.035 10.7270/Q21R6S09 24411477 Tian, M; Abdelrahman, A; Weinhausen, S; Hinz, S; Weyer, S; Dosa, S; El-Tayeb, A; Muller, CE University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50446076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50446076&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 766793 194943972 CHEMBL1483754 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51033960 [O-]S(=O)(=O)c1cc(c2c(NC(=O)c3ccc(F)c(NC(=O)c4cccc(NC(=O)Nc5cccc(c5)C(=O)Nc5cc(ccc5F)C(=O)Nc5ccc(c6cc(cc(c56)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)c4)c3)ccc(c2c1)S([O-])(=O)=O)S([O-])(=O)=O InChI=1S/C49H34F2N6O23S6/c50-33-9-7-25(47(60)54-35-11-13-39(83(69,70)71)31-19-29(81(63,64)65)21-41(43(31)35)85(75,76)77)17-37(33)56-45(58)23-3-1-5-27(15-23)52-49(62)53-28-6-2-4-24(16-28)46(59)57-38-18-26(8-10-34(38)51)48(61)55-36-12-14-40(84(72,73)74)32-20-30(82(66,67)68)22-42(44(32)36)86(78,79)80/h1-22H,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/p-6 UDVIAMRWOLIUAE-UHFFFAOYSA-H 50422739 CHEMBL413145 P2X purinoceptor 4 Rattus 81 ChEMBL 10.1021/jm050301p 10.7270/Q2JM2BZ7 16250663 Ullmann, H; Meis, S; Hongwiset, D; Marzian, C; Wiese, M; Nickel, P; Communi, D; Boeynaems, JM; Wolf, C; Hausmann, R; Schmalzing, G; Kassack, MU University of Bonn http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422739&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 91900207 164151614 CHEMBL413145 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51236557 NS(=O)(=O)c1cc(NC(=O)Cc2ccccc2)ccc1Oc1cccc(Cl)c1 InChI=1S/C20H17ClN2O4S/c21-15-7-4-8-17(12-15)27-18-10-9-16(13-19(18)28(22,25)26)23-20(24)11-14-5-2-1-3-6-14/h1-10,12-13H,11H2,(H,23,24)(H2,22,25,26) CSJYMAFXYMYNCK-UHFFFAOYSA-N 50506158 CHEMBL4521594 P2X purinoceptor 4 Rattus 233 ChEMBL 10.1021/acs.jmedchem.9b01304 10.7270/Q2M048RW 31746599 Werner, S; Mesch, S; Hillig, RC; Ter Laak, A; Klint, J; Neagoe, I; Laux-Biehlmann, A; Dahllöf, H; Bräuer, N; Puetter, V; Nubbemeyer, R; Schulz, S; Bairlein, M; Zollner, TM; Steinmeyer, A Bayer AG http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506158&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 124125214 440714743 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51236611 Fc1ccc(cc1)[C@@H]1CCNC[C@H]1COc1ccc2OCOc2c1 InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1 AHOUBRCZNHFOSL-YOEHRIQHSA-N 22416 (3S,4R)-3-[(1,3-benzodioxol-5-yloxy)methyl]-4-(4-fluorophenyl)piperidine::(3S,4R)-3-[(2H-1,3-benzodioxol-5-yloxy)methyl]-4-(4-fluorophenyl)piperidine::CHEMBL490::PAROXETINE::US09969700, Paroxetine::US9944618, Compound ID No. 182::[3H]Paroxetine P2X purinoceptor 4 Rattus 2450 ChEMBL 10.1021/acs.jmedchem.9b01304 10.7270/Q2M048RW 31746599 Werner, S; Mesch, S; Hillig, RC; Ter Laak, A; Klint, J; Neagoe, I; Laux-Biehlmann, A; Dahllöf, H; Bräuer, N; Puetter, V; Nubbemeyer, R; Schulz, S; Bairlein, M; Zollner, TM; Steinmeyer, A Bayer AG http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=22416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=22416&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 8PR 6F6I,7OIH,6DZW,6AWN,4JLT,3V5W,4MM4,6VRH,5I6X,4L9I 43815 49846231 7936 CHEMBL490 DB00715 4561 C07415 ZINC00527386 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577 51461833 Brc1cccc(c1)C1=NCC(=O)Nc2c1oc1ccccc21 InChI=1S/C17H11BrN2O2/c18-11-5-3-4-10(8-11)15-17-16(20-14(21)9-19-15)12-6-1-2-7-13(12)22-17/h1-8H,9H2,(H,20,21) NKYMVQPXXTZHSF-UHFFFAOYSA-N 50399207 CHEMBL2180179 P2X purinoceptor 4 Rattus 750 ChEMBL 10.7270/Q2RX9H1T 36150180 Toti, KS; Verma, R; McGonnigle, MJ; Gamiotea Turro, D; Wen, Z; Lewicki, SA; Liang, BT; Jacobson, KA National Institute of Diabetes and Digestive and Kidney Diseases http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50399207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=49000986&target=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50399207&enzyme=P2X+purinoceptor+4&column=ki&startPg=0&Increment=50&submit=Search 9841560 163348231 CHEMBL2180179 ZINC33982888 1 MAGCCSVLGSFLFEYDTPRIVLIRSRKVGLMNRAVQLLILAYVIGWVFVWEKGYQETDSVVSSVTTKAKGVAVTNTSQLGFRIWDVADYVIPAQEENSLFIMTNMIVTVNQTQSTCPEIPDKTSICNSDADCTPGSVDTHSSGVATGRCVPFNESVKTCEVAAWCPVENDVGVPTPAFLKAAENFTLLVKNNIWYPKFNFSKRNILPNITTSYLKSCIYNAQTDPFCPIFRLGTIVEDAGHSFQEMAVEGGIMGIQIKWDCNLDRAASLCLPRYSFRRLDTRDLEHNVSPGYNFRFAKYYRDLAGKEQRTLTKAYGIRFDIIVFGKAGKFDIIPTMINVGSGLALLGVATVLCDVIVLYCMKKKYYYRDKKYKYVEDYEQGLSGEMNQ 2RUP P2X purinoceptor 4 P2RX4_RAT P51577