Compile Data Set for Download or QSAR

Found 37 hits of ic50 for UniProtKB: P33260   

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
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105809 (4-Amino-N-isopropyl-N-(2-phenyl-2H-pyrazol-3-yl)-b...) Show SMILES CC(C)N(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C18H20N4O2S/c1-14(2)22(25(23,24)17-10-8-15(19)9-11-17)18-12-13-20-21(18)16-6-4-3-5-7-16/h3-14H,19H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105810 (3'-Amino-biphenyl-4-sulfonic acid (3-hydroxy-propy...) Show SMILES Nc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N(CCCO)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C24H24N4O3S/c25-21-7-4-6-20(18-21)19-10-12-23(13-11-19)32(30,31)27(16-5-17-29)24-14-15-26-28(24)22-8-2-1-3-9-22/h1-4,6-15,18,29H,5,16-17,25H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105811 (3'-Nitro-biphenyl-4-sulfonic acid (4-hydroxy-butyl...) Show SMILES OCCCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C25H24N4O5S/c30-18-5-4-17-27(25-15-16-26-28(25)22-8-2-1-3-9-22)35(33,34)24-13-11-20(12-14-24)21-7-6-10-23(19-21)29(31)32/h1-3,6-16,19,30H,4-5,17-18H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105812 (3'-Nitro-biphenyl-4-sulfonic acid (2-phenyl-2H-pyr...) Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Show InChI InChI=1S/C21H16N4O4S/c26-25(27)19-8-4-5-17(15-19)16-9-11-20(12-10-16)30(28,29)23-21-13-14-22-24(21)18-6-2-1-3-7-18/h1-15,23H	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461264 (US10774056, Compound 028 | US11542242, Compound 02...) Show SMILES CN1CCN(CC1)c1ccc(nc1)C(=O)Nc1cc(ccc1N)-c1ccncc1 Show InChI InChI=1S/C22H24N6O/c1-27-10-12-28(13-11-27)18-3-5-20(25-15-18)22(29)26-21-14-17(2-4-19(21)23)16-6-8-24-9-7-16/h2-9,14-15H,10-13,23H2,1H3,(H,26,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105825 (4-Amino-N-butyl-N-(2-phenyl-2H-pyrazol-3-yl)-benze...) Show SMILES CCCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C19H22N4O2S/c1-2-3-15-22(26(24,25)18-11-9-16(20)10-12-18)19-13-14-21-23(19)17-7-5-4-6-8-17/h4-14H,2-3,15,20H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105820 (4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...) Show SMILES Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C22H20N4O2S/c23-19-11-13-21(14-12-19)29(27,28)25(17-18-7-3-1-4-8-18)22-15-16-24-26(22)20-9-5-2-6-10-20/h1-16H,17,23H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105821 (4-Amino-N-ethyl-N-(2-phenyl-2H-pyrazol-3-yl)-benze...) Show SMILES CCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C17H18N4O2S/c1-2-20(24(22,23)16-10-8-14(18)9-11-16)17-12-13-19-21(17)15-6-4-3-5-7-15/h3-13H,2,18H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105816 (4-Amino-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-benz...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C18H20N4O2S/c1-2-14-21(25(23,24)17-10-8-15(19)9-11-17)18-12-13-20-22(18)16-6-4-3-5-7-16/h3-13H,2,14,19H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105808 (3'-Nitro-biphenyl-4-sulfonic acid (3-hydroxy-propy...) Show SMILES OCCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C24H22N4O5S/c29-17-5-16-26(24-14-15-25-27(24)21-7-2-1-3-8-21)34(32,33)23-12-10-19(11-13-23)20-6-4-9-22(18-20)28(30)31/h1-4,6-15,18,29H,5,16-17H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105814 (4-Amino-N-(3-methyl-butyl)-N-(2-phenyl-2H-pyrazol-...) Show SMILES CC(C)CCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C20H24N4O2S/c1-16(2)13-15-23(27(25,26)19-10-8-17(21)9-11-19)20-12-14-22-24(20)18-6-4-3-5-7-18/h3-12,14,16H,13,15,21H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105817 (3'-Nitro-biphenyl-4-sulfonic acid (2-hydroxy-ethyl...) Show SMILES OCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C23H20N4O5S/c28-16-15-25(23-13-14-24-26(23)20-6-2-1-3-7-20)33(31,32)22-11-9-18(10-12-22)19-5-4-8-21(17-19)27(29)30/h1-14,17,28H,15-16H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461268 (US10774056, Compound 032 | US11542242, Compound 03...) Show SMILES Nc1ccc(cc1NC(=O)c1cnc(s1)N1CCNCC1)-c1ccncc1 Show InChI InChI=1S/C19H20N6OS/c20-15-2-1-14(13-3-5-21-6-4-13)11-16(15)24-18(26)17-12-23-19(27-17)25-9-7-22-8-10-25/h1-6,11-12,22H,7-10,20H2,(H,24,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461261 (US10774056, Compound 025 | US11542242, Compound 02...) Show SMILES Nc1ccc(cc1NC(=O)c1cnc2cc(ccc2c1)N1CCNCC1)-c1ccoc1 Show InChI InChI=1S/C24H23N5O2/c25-21-4-2-16(18-5-10-31-15-18)12-23(21)28-24(30)19-11-17-1-3-20(13-22(17)27-14-19)29-8-6-26-7-9-29/h1-5,10-15,26H,6-9,25H2,(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105828 (4-Allyl-N-methyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...) Show SMILES CN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(CC=C)cc1 Show InChI InChI=1S/C19H19N3O2S/c1-3-7-16-10-12-18(13-11-16)25(23,24)21(2)19-14-15-20-22(19)17-8-5-4-6-9-17/h3-6,8-15H,1,7H2,2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461263 (US10774056, Compound 027 | US11542242, Compound 02...) Show SMILES CN1CCN(CC1)c1ccc(cn1)C(=O)Nc1cc(ccc1N)-c1ccncc1 Show InChI InChI=1S/C22H24N6O/c1-27-10-12-28(13-11-27)21-5-3-18(15-25-21)22(29)26-20-14-17(2-4-19(20)23)16-6-8-24-9-7-16/h2-9,14-15H,10-13,23H2,1H3,(H,26,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461266 (US10774056, Compound 030 | US11542242, Compound 03...) Show SMILES CN1CCN(CC1)c1ncc(s1)C(=O)Nc1cc(ccc1N)-c1cccs1 Show InChI InChI=1S/C19H21N5OS2/c1-23-6-8-24(9-7-23)19-21-12-17(27-19)18(25)22-15-11-13(4-5-14(15)20)16-3-2-10-26-16/h2-5,10-12H,6-9,20H2,1H3,(H,22,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461256 (US10774056, Compound 003 | US11542242, Compound 00...) Show SMILES Nc1ccc(cc1NC(=O)c1ccc2nc(ccc2c1)N1CCNCC1)-c1ccco1 Show InChI InChI=1S/C24H23N5O2/c25-19-6-3-17(22-2-1-13-31-22)15-21(19)28-24(30)18-4-7-20-16(14-18)5-8-23(27-20)29-11-9-26-10-12-29/h1-8,13-15,26H,9-12,25H2,(H,28,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461258 (US10774056, Compound 007 | US11542242, Compound 00...) Show SMILES Nc1ccc(cc1NC(=O)c1ccc(nc1)N1CCNCC1)-c1cccs1 Show InChI InChI=1S/C20H21N5OS/c21-16-5-3-14(18-2-1-11-27-18)12-17(16)24-20(26)15-4-6-19(23-13-15)25-9-7-22-8-10-25/h1-6,11-13,22H,7-10,21H2,(H,24,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461257 (US10774056, Compound 006 | US11542242, Compound 00...) Show SMILES Nc1ccc(cc1NC(=O)c1ccc(nc1)N1CCNCC1)-c1ccccc1 Show InChI InChI=1S/C22H23N5O/c23-19-8-6-17(16-4-2-1-3-5-16)14-20(19)26-22(28)18-7-9-21(25-15-18)27-12-10-24-11-13-27/h1-9,14-15,24H,10-13,23H2,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 (Homo sapiens (Human))	BDBM50508661 (CHEMBL4524830) Show SMILES Cn1cc(C2CCCCC2)c2cc(F)c(cc12)C(=O)NS(=O)(=O)C1CC1 Show InChI InChI=1S/C19H23FN2O3S/c1-22-11-16(12-5-3-2-4-6-12)14-9-17(20)15(10-18(14)22)19(23)21-26(24,25)13-7-8-13/h9-13H,2-8H2,1H3,(H,21,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human CYP450				Bioorg Med Chem Lett 29: 659-663 (2019) Article DOI: 10.1016/j.bmcl.2018.12.013 BindingDB Entry DOI: 10.7270/Q2K64NC8
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461260 (US10774056, Compound 022 | US11542242, Compound 02...) Show SMILES Nc1ccc(cc1NC(=O)c1cc2ccc(cc2cn1)N1CCNCC1)-c1ccccc1 Show InChI InChI=1S/C26H25N5O/c27-23-9-7-19(18-4-2-1-3-5-18)15-24(23)30-26(32)25-16-20-6-8-22(14-21(20)17-29-25)31-12-10-28-11-13-31/h1-9,14-17,28H,10-13,27H2,(H,30,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 1A2/2C18/2C19 (Homo sapiens (Human))	BDBM461267 (US10774056, Compound 031 | US11542242, Compound 03...) Show SMILES Cc1nc(sc1C(=O)Nc1cc(ccc1N)-c1cccs1)N1CCNCC1 Show InChI InChI=1S/C19H21N5OS2/c1-12-17(27-19(22-12)24-8-6-21-7-9-24)18(25)23-15-11-13(4-5-14(15)20)16-3-2-10-26-16/h2-5,10-11,21H,6-9,20H2,1H3,(H,23,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, INC. US Patent					Assay Description For Cyp inhibition, human liver microsomes from BD Gentest were incubated with Compound 028 or Compound 032 (10, 3.33, 1.11, 0.37, 0.12, 0.04, 0.01 &...				US Patent US10774056 (2020) BindingDB Entry DOI: 10.7270/Q25D8VXS
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105824 (4,N-Dimethyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenes...) Show SMILES CN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C17H17N3O2S/c1-14-8-10-16(11-9-14)23(21,22)19(2)17-12-13-18-20(17)15-6-4-3-5-7-15/h3-13H,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105818 (4-Amino-N-methyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...) Show SMILES CN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C16H16N4O2S/c1-19(23(21,22)15-9-7-13(17)8-10-15)16-11-12-18-20(16)14-5-3-2-4-6-14/h2-12H,17H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105815 (4-Allyl-N-(3-hydroxy-propyl)-N-(2-phenyl-2H-pyrazo...) Show SMILES OCCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(CC=C)cc1 Show InChI InChI=1S/C21H23N3O3S/c1-2-7-18-10-12-20(13-11-18)28(26,27)23(16-6-17-25)21-14-15-22-24(21)19-8-4-3-5-9-19/h2-5,8-15,25H,1,6-7,16-17H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105822 (3'-Amino-biphenyl-4-sulfonic acid (2-phenyl-2H-pyr...) Show SMILES Nc1cccc(c1)-c1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Show InChI InChI=1S/C21H18N4O2S/c22-18-6-4-5-17(15-18)16-9-11-20(12-10-16)28(26,27)24-21-13-14-23-25(21)19-7-2-1-3-8-19/h1-15,24H,22H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105823 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-ben...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C19H21N3O2S/c1-3-15-21(25(23,24)18-11-9-16(2)10-12-18)19-13-14-20-22(19)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50548260 (Pongapin) Show SMILES COc1c(oc2c3ccoc3ccc2c1=O)-c1ccc2OCOc2c1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human CYP2C18 expressed in Sacchrosomes by fluorescence based assay				Citation and Details Article DOI: 10.1016/j.bmc.2018.11.013 BindingDB Entry DOI: 10.7270/Q20V8HDV
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50548258 (LANCEOLATIN B) Show SMILES O=c1cc(oc2c3ccoc3ccc12)-c1ccccc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human CYP2C18 expressed in Sacchrosomes by fluorescence based assay				Citation and Details Article DOI: 10.1016/j.bmc.2018.11.013 BindingDB Entry DOI: 10.7270/Q20V8HDV
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105819 (4-Amino-N-(3-hydroxy-propyl)-N-(2-phenyl-2H-pyrazo...) Show SMILES Nc1ccc(cc1)S(=O)(=O)N(CCCO)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C18H20N4O3S/c19-15-7-9-17(10-8-15)26(24,25)21(13-4-14-23)18-11-12-20-22(18)16-5-2-1-3-6-16/h1-3,5-12,23H,4,13-14,19H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105826 (4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-pheny...) Show SMILES NCCCc1ccc(cc1)S(=O)(=O)N(CCCO)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C21H26N4O3S/c22-14-4-6-18-9-11-20(12-10-18)29(27,28)24(16-5-17-26)21-13-15-23-25(21)19-7-2-1-3-8-19/h1-3,7-13,15,26H,4-6,14,16-17,22H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50090677 (4-Amino-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfon...) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Show InChI InChI=1S/C15H14N4O2S/c16-12-6-8-14(9-7-12)22(20,21)18-15-10-11-17-19(15)13-4-2-1-3-5-13/h1-11,18H,16H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105807 (4-(2-Amino-ethyl)-N-(3-hydroxy-propyl)-N-(2-phenyl...) Show SMILES NCCc1ccc(cc1)S(=O)(=O)N(CCCO)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C20H24N4O3S/c21-13-11-17-7-9-19(10-8-17)28(26,27)23(15-4-16-25)20-12-14-22-24(20)18-5-2-1-3-6-18/h1-3,5-10,12,14,25H,4,11,13,15-16,21H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105813 (4-Allyl-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...) Show SMILES C=CCc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1 Show InChI InChI=1S/C25H23N3O2S/c1-2-9-21-14-16-24(17-15-21)31(29,30)27(20-22-10-5-3-6-11-22)25-18-19-26-28(25)23-12-7-4-8-13-23/h2-8,10-19H,1,9,20H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50105827 (4-Allyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfon...) Show SMILES C=CCc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Show InChI InChI=1S/C18H17N3O2S/c1-2-6-15-9-11-17(12-10-15)24(22,23)20-18-13-14-19-21(18)16-7-4-3-5-8-16/h2-5,7-14,20H,1,6H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair
Cytochrome P450 2C18 (Homo sapiens (Human))	BDBM50090669 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfo...) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Show InChI InChI=1S/C16H15N3O2S/c1-13-7-9-15(10-8-13)22(20,21)18-16-11-12-17-19(16)14-5-3-2-4-6-14/h2-12,18H,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris V Curated by ChEMBL					Assay Description Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain				J Med Chem 44: 3622-31 (2001) BindingDB Entry DOI: 10.7270/Q20Z72KC
					More data for this Ligand-Target Pair