Compile Data Set for Download or QSAR

Found 11 hits of ic50 for UniProtKB: P9WPV3   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530527 (CHEMBL3402635) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1cc(C)cc(C)c1 Show InChI InChI=1S/C29H32ClN3O3S/c1-6-32(7-2)18-22-16-24(9-11-29(22)34)33(37(35,36)25-13-19(3)12-20(4)14-25)28-15-21(5)31-27-17-23(30)8-10-26(27)28/h8-17,34H,6-7,18H2,1-5H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530528 (CHEMBL3402627) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C27H27Cl2N3O3S/c1-4-31(5-2)17-19-15-22(9-13-27(19)33)32(36(34,35)23-10-6-20(28)7-11-23)26-14-18(3)30-25-16-21(29)8-12-24(25)26/h6-16,33H,4-5,17H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530529 (CHEMBL3402631) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C27H26Cl3N3O3S/c1-4-32(5-2)16-18-13-21(8-10-26(18)34)33(37(35,36)27-11-7-19(28)14-23(27)30)25-12-17(3)31-24-15-20(29)6-9-22(24)25/h6-15,34H,4-5,16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530530 (CHEMBL3402629) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C27H27ClN4O5S/c1-4-30(5-2)17-19-15-22(9-13-27(19)33)31(38(36,37)23-10-7-21(8-11-23)32(34)35)26-14-18(3)29-25-16-20(28)6-12-24(25)26/h6-16,33H,4-5,17H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530531 (CHEMBL3402630) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1cccc(Cl)c1Cl Show InChI InChI=1S/C27H26Cl3N3O3S/c1-4-32(5-2)16-18-14-20(10-12-25(18)34)33(37(35,36)26-8-6-7-22(29)27(26)30)24-13-17(3)31-23-15-19(28)9-11-21(23)24/h6-15,34H,4-5,16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530531 (CHEMBL3402630) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1cccc(Cl)c1Cl Show InChI InChI=1S/C27H26Cl3N3O3S/c1-4-32(5-2)16-18-14-20(10-12-25(18)34)33(37(35,36)26-8-6-7-22(29)27(26)30)24-13-17(3)31-23-15-19(28)9-11-21(23)24/h6-15,34H,4-5,16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530529 (CHEMBL3402631) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C27H26Cl3N3O3S/c1-4-32(5-2)16-18-13-21(8-10-26(18)34)33(37(35,36)27-11-7-19(28)14-23(27)30)25-12-17(3)31-24-15-20(29)6-9-22(24)25/h6-15,34H,4-5,16H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530526 (CHEMBL3400982) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(Cl)s1 Show InChI InChI=1S/C25H25Cl2N3O3S2/c1-4-29(5-2)15-17-13-19(7-9-23(17)31)30(35(32,33)25-11-10-24(27)34-25)22-12-16(3)28-21-14-18(26)6-8-20(21)22/h6-14,31H,4-5,15H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530528 (CHEMBL3402627) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C27H27Cl2N3O3S/c1-4-31(5-2)17-19-15-22(9-13-27(19)33)32(36(34,35)23-10-6-20(28)7-11-23)26-14-18(3)30-25-16-21(29)8-12-24(25)26/h6-16,33H,4-5,17H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530527 (CHEMBL3402635) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1cc(C)cc(C)c1 Show InChI InChI=1S/C29H32ClN3O3S/c1-6-32(7-2)18-22-16-24(9-11-29(22)34)33(37(35,36)25-13-19(3)12-20(4)14-25)28-15-21(5)31-27-17-23(30)8-10-26(27)28/h8-17,34H,6-7,18H2,1-5H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair
ATP synthase subunit b-delta (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50530530 (CHEMBL3402629) Show SMILES CCN(CC)Cc1cc(ccc1O)N(c1cc(C)nc2cc(Cl)ccc12)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C27H27ClN4O5S/c1-4-30(5-2)17-19-15-22(9-13-27(19)33)31(38(36,37)23-10-7-21(8-11-23)32(34)35)26-14-18(3)29-25-16-20(28)6-12-24(25)26/h6-16,33H,4-5,17H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of ATP synthase in Mycobacterium tuberculosis H37Rv				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111644 BindingDB Entry DOI: 10.7270/Q26M3B8J
					More data for this Ligand-Target Pair