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
51495319	CC(C)[C@H]1CO[C@]23CCN(Cc4ccccc4)C[C@H]2CCC(=O)N13	InChI=1S/C20H28N2O2/c1-15(2)18-14-24-20-10-11-21(12-16-6-4-3-5-7-16)13-17(20)8-9-19(23)22(18)20/h3-7,15,17-18H,8-14H2,1-2H3/t17-,18-,20-/m1/s1	XJYVCBMQCHHPSW-QWFCFKBJSA-N	50602366	CHEMBL5182198	Type II NADH:quinone oxidoreductase NdhA			 980							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602366	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602366&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168275580	482613217							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6						
51495320	COc1ccc(CN2CC[C@]34OC[C@H](C(C)C)N3C(=O)CC[C@@H]4C2)cc1	InChI=1S/C21H30N2O3/c1-15(2)19-14-26-21-10-11-22(12-16-4-7-18(25-3)8-5-16)13-17(21)6-9-20(24)23(19)21/h4-5,7-8,15,17,19H,6,9-14H2,1-3H3/t17-,19-,21-/m1/s1	YLBHJBBTUJVMCK-YFVAEKQCSA-N	50602367	CHEMBL5206556	Type II NADH:quinone oxidoreductase NdhA			 2340							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602367	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602367&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168296252	482613218							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6						
51495321	CC(C)[C@H]1CO[C@]23CCN(Cc4ccc(Cl)cc4)C[C@H]2CCC(=O)N13	InChI=1S/C20H27ClN2O2/c1-14(2)18-13-25-20-9-10-22(11-15-3-6-17(21)7-4-15)12-16(20)5-8-19(24)23(18)20/h3-4,6-7,14,16,18H,5,8-13H2,1-2H3/t16-,18-,20-/m1/s1	ODUYWULJYRWPSN-YVWKXTFCSA-N	50602368	CHEMBL5171834	Type II NADH:quinone oxidoreductase NdhA			 96							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602368	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602368&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168270488	482613219							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6						
51495322	CC(C)[C@H]1CO[C@]23CCN(Cc4ccc(cc4)C(F)(F)F)C[C@H]2CCC(=O)N13	InChI=1S/C21H27F3N2O2/c1-14(2)18-13-28-20-9-10-25(12-17(20)7-8-19(27)26(18)20)11-15-3-5-16(6-4-15)21(22,23)24/h3-6,14,17-18H,7-13H2,1-2H3/t17-,18-,20-/m1/s1	PAMPCWHQTAFLOF-QWFCFKBJSA-N	50602369	CHEMBL5201484	Type II NADH:quinone oxidoreductase NdhA			 59							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602369	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602369&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168291879	482613220							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6						
51495323	CC(C)[C@H]1CO[C@]23CCN(Cc4ccc(OC(F)(F)F)cc4)C[C@H]2CCC(=O)N13	InChI=1S/C21H27F3N2O3/c1-14(2)18-13-28-20-9-10-25(12-16(20)5-8-19(27)26(18)20)11-15-3-6-17(7-4-15)29-21(22,23)24/h3-4,6-7,14,16,18H,5,8-13H2,1-2H3/t16-,18-,20-/m1/s1	NELFXUPMACHOGC-YVWKXTFCSA-N	50602370	CHEMBL5186518	Type II NADH:quinone oxidoreductase NdhA			 57							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602370	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602370&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168279913	482613221							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6						
51495324	CC(C)[C@H]1CO[C@]23CCN(Cc4ccc(nc4)C(F)(F)F)C[C@H]2CCC(=O)N13	InChI=1S/C20H26F3N3O2/c1-13(2)16-12-28-19-7-8-25(11-15(19)4-6-18(27)26(16)19)10-14-3-5-17(24-9-14)20(21,22)23/h3,5,9,13,15-16H,4,6-8,10-12H2,1-2H3/t15-,16-,19-/m1/s1	SSCSXGXGTCGKOK-GPMSIDNRSA-N	50602371	CHEMBL5202255	Type II NADH:quinone oxidoreductase NdhA			 330							ChEMBL		10.7270/Q24F1VTT	36473699			Dam, S; Tangara, S; Hamela, C; Hattabi, T; Faïon, L; Carre, P; Antoine, R; Herledan, A; Leroux, F; Piveteau, C; Eveque, M; Flipo, M; Deprez, B; Kremer, L; Willand, N; Villemagne, B; Hartkoorn, RC	CNRS	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50602371	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50001363&target=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50602371&enzyme=Type+II+NADH%3Aquinone+oxidoreductase+NdhA&column=ki&startPg=0&Increment=50&submit=Search			168292664	482613222							1	MTLSSGEPSAVGGRHRVVIIGSGFGGLNAAKALKRADVDITLISKTTTHLFQPLLYQVATGILSEGDIAPTTRLILRRQKNVRVLLGEVNAIDLKAQTVTSKLMDMTTVTPYDSLIVAAGAQQSYFGNDEFATFAPGMKTIDDALELRGRILGAFEAAEVSTDHAERERRLTFVVVGAGPTGVEVAGQIVELAERTLAGAFRTITPSECRVILLDAAPAVLPPMGPKLGLKAQRRLEKMDVEVQLNAMVTAVDYKGITIKEKDGGERRIECACKVWAAGVAASPLGKMIAEGSDGTEIDRAGRVIVEPDLTVKGHPNVFVVGDLMFVPGVPGVAQGAIQGARYATTVIKHMVKGNDDPANRKPFHYFNKGSMATISRHSAVAQVGKLEFAGYFAWLAWLVLHLVYLVGYRNRIAALFAWGISFMGRARGQMAITSQMIYARLVMTLMEQQAQGALAAAEQAEHAEQEAAG		Type II NADH:quinone oxidoreductase NdhA	NDHA_MYCTU	P95200	F2GN78 I6WYA2 Q7D9W6