Compile Data Set for Download or QSAR

Found 93 hits with Last Name = 'belle' and Initial = 'c'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tyrosinase (Homo sapiens (Human))	BDBM50205807 (CHEMBL3978212) Show SMILES Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(=O)n(O)c1 Show InChI InChI=1S/C14H9NO5/c16-9-2-3-10-11(6-9)20-12(14(10)18)5-8-1-4-13(17)15(19)7-8/h1-7,16,19H/b12-5-	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Grenoble-Alpes/CNRS Curated by ChEMBL					Assay Description Inhibition of recombinant human tyrosinase expressed in baculovirus infected Sf9 cells assessed as diphenolase activity using L-DOPA as substrate by ...				ACS Med Chem Lett 8: 55-60 (2017) Article DOI: 10.1021/acsmedchemlett.6b00369 BindingDB Entry DOI: 10.7270/Q24F1SQN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50205815 (CHEMBL3907670) Show SMILES Oc1cccc2O\C(=C/c3ccc(=O)n(O)c3)C(=O)c12 Show InChI InChI=1S/C14H9NO5/c16-9-2-1-3-10-13(9)14(18)11(20-10)6-8-4-5-12(17)15(19)7-8/h1-7,16,19H/b11-6-	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Grenoble-Alpes/CNRS Curated by ChEMBL					Assay Description Inhibition of recombinant human tyrosinase expressed in baculovirus infected Sf9 cells assessed as diphenolase activity using L-DOPA as substrate by ...				ACS Med Chem Lett 8: 55-60 (2017) Article DOI: 10.1021/acsmedchemlett.6b00369 BindingDB Entry DOI: 10.7270/Q24F1SQN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50205806 (CHEMBL3969839) Show SMILES Oc1cc2O\C(=C/c3ccc(=O)n(O)c3)C(=O)c2c(O)c1 Show InChI InChI=1S/C14H9NO6/c16-8-4-9(17)13-10(5-8)21-11(14(13)19)3-7-1-2-12(18)15(20)6-7/h1-6,16-17,20H/b11-3-	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Grenoble-Alpes/CNRS Curated by ChEMBL					Assay Description Inhibition of recombinant human tyrosinase expressed in baculovirus infected Sf9 cells assessed as diphenolase activity using L-DOPA as substrate by ...				ACS Med Chem Lett 8: 55-60 (2017) Article DOI: 10.1021/acsmedchemlett.6b00369 BindingDB Entry DOI: 10.7270/Q24F1SQN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50205814 (CHEMBL3898657) Show SMILES Oc1cccc[n+]1[O-] Show InChI InChI=1S/C5H5NO2/c7-5-3-1-2-4-6(5)8/h1-4,7H	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	1.28E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Grenoble-Alpes/CNRS Curated by ChEMBL					Assay Description Inhibition of recombinant human tyrosinase expressed in baculovirus infected Sf9 cells assessed as diphenolase activity using L-DOPA as substrate by ...				ACS Med Chem Lett 8: 55-60 (2017) Article DOI: 10.1021/acsmedchemlett.6b00369 BindingDB Entry DOI: 10.7270/Q24F1SQN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50031467 (5-HYDROXY-2-(HYDROXYMETHYL)-4H-PYRAN-4-ONE | 5-Hyd...) Show SMILES OCc1cc(=O)c(O)co1 Show InChI InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	3.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Grenoble-Alpes/CNRS Curated by ChEMBL					Assay Description Inhibition of recombinant human tyrosinase expressed in baculovirus infected Sf9 cells assessed as diphenolase activity using L-DOPA as substrate by ...				ACS Med Chem Lett 8: 55-60 (2017) Article DOI: 10.1021/acsmedchemlett.6b00369 BindingDB Entry DOI: 10.7270/Q24F1SQN
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate compared with finasteride in experiment 1				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057290 ((5aS,7aS,10aS,10bS)-7a-Methyl-1,5a,6,7,7a,9,10,10a...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4CC(=O)C=CN34)[C@@H]1CCC2=O |c:12| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h7,9,11,13-15H,2-6,8,10H2,1H3/t11?,13-,14-,15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057297 ((5aS,7aS,8S,10aS,10bS)-8-Hydroxy-7a-methyl-3,4,6,7...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CC[C@@H]2O |t:8| Show InChI InChI=1S/C17H25NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-16,20H,2-9H2,1H3/t13-,14-,15-,16-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057289 ((5aS,7aS,10aS,10bS,12aS)-7a-Methyl-tetradecahydro-...) Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CCN34)[C@@H]1CCC2=O Show InChI InChI=1S/C17H25NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h11,13-15H,2-10H2,1H3/t11-,13-,14-,15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369338 (CHEMBL1237294) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CC[C@@H]2O |r,c:3,t:8| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14,16,20H,2-5,7-9H2,1H3/t13-,14?,16-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50334788 ((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:18| Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057292 ((5aS,7aS,10aS,10bS)-7a-Methyl-3,4,5a,6,7,7a,9,10,1...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CCC2=O |t:8| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-15H,2-9H2,1H3/t13-,14-,15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369336 (CHEMBL1237306) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CCC2=O |r,c:3,t:8| Show InChI InChI=1S/C17H21NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14H,2-5,7-9H2,1H3/t13-,14?,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate compared with finasteride in experiment 3				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057295 ((5aS,7aS,8S,10aS,10bS)-7a-Methyl-2-oxo-2,3,4,5a,6,...) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CCN4[C@H]3CC[C@]12C |t:14| Show InChI InChI=1S/C22H34N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h13,16-19H,5-12H2,1-4H3,(H,23,26)/t16-,17-,18+,19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate compared with finasteride in experiment 2				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369334 (CHEMBL1237307) Show SMILES C[C@]12CCC3=C4C(=O)CCN=C4CCC3[C@@H]1CCC2=O |r,c:4,10| Show InChI InChI=1S/C17H21NO2/c1-17-8-6-11-10(12(17)3-5-15(17)20)2-4-13-16(11)14(19)7-9-18-13/h10,12H,2-9H2,1H3/t10?,12-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369337 (CHEMBL1794821) Show SMILES C[C@]12CCC3=NC(CC(=O)C=C)=CCC3[C@@H]1CCC2=O |c:11,t:4| Show InChI InChI=1S/C17H21NO2/c1-3-12(19)10-11-4-5-13-14-6-7-16(20)17(14,2)9-8-15(13)18-11/h3-4,13-14H,1,5-10H2,2H3/t13?,14-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibition against 5 alpha R-2 in human prostate homogenate relative to finasteride				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Tested against 5 alpha R-2 on human prostate homogenate from surgically derived benign hyperplastic tissue in experiment 2				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Tested against 5 alpha R-2 on human prostate homogenate from surgically derived benign hyperplastic tissue in experiment 1				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue in experiment 1				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50334788 ((17beta-(N-tert-butylcarbamoyl)-4-aza-5alpha-andro...) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:18| Show InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description TInhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue in experiment 2				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	127	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369335 (CHEMBL1201841) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |r,c:23,t:14| Show InChI InChI=1S/C22H32N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h9,13,16-18H,5-8,10-12H2,1-4H3,(H,23,26)/t16?,17-,18+,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Tested against 5 alpha R-2 on human prostate homogenate from surgically derived benign hyperplastic tissue in experiment 3				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Homo sapiens (Human))	BDBM50369336 (CHEMBL1237306) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CCC2=O |r,c:3,t:8| Show InChI InChI=1S/C17H21NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14H,2-5,7-9H2,1H3/t13-,14?,17-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Homo sapiens (Human))	BDBM50057292 ((5aS,7aS,10aS,10bS)-7a-Methyl-3,4,5a,6,7,7a,9,10,1...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CCC2=O |t:8| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-15H,2-9H2,1H3/t13-,14-,15-,17-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	299	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Homo sapiens (Human))	BDBM50057297 ((5aS,7aS,8S,10aS,10bS)-8-Hydroxy-7a-methyl-3,4,6,7...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CC[C@@H]2O |t:8| Show InChI InChI=1S/C17H25NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-16,20H,2-9H2,1H3/t13-,14-,15-,16-,17-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	409	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057295 ((5aS,7aS,8S,10aS,10bS)-7a-Methyl-2-oxo-2,3,4,5a,6,...) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CCN4[C@H]3CC[C@]12C |t:14| Show InChI InChI=1S/C22H34N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h13,16-19H,5-12H2,1-4H3,(H,23,26)/t16-,17-,18+,19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Homo sapiens (Human))	BDBM50057295 ((5aS,7aS,8S,10aS,10bS)-7a-Methyl-2-oxo-2,3,4,5a,6,...) Show SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CCN4[C@H]3CC[C@]12C |t:14| Show InChI InChI=1S/C22H34N2O2/c1-21(2,3)23-20(26)18-8-7-17-16-6-5-14-13-15(25)10-12-24(14)19(16)9-11-22(17,18)4/h13,16-19H,5-12H2,1-4H3,(H,23,26)/t16-,17-,18+,19-,22-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human 5-alpha Reductase-1 expressed in DU-145 cells				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177653 (5-allyl-6-chloro-2-(2,3-dihydro-1H-inden-5-ylamino...) Show SMILES Clc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CC=C Show InChI InChI=1S/C16H16ClN3O/c1-2-4-13-14(17)19-16(20-15(13)21)18-12-8-7-10-5-3-6-11(10)9-12/h2,7-9H,1,3-6H2,(H2,18,19,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177648 (2-(2,3-dihydro-1H-inden-5-ylamino)-6-hydroxy-5-(3-...) Show SMILES Oc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CCCOc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C22H22N4O5/c27-20-19(5-2-12-31-18-10-8-17(9-11-18)26(29)30)21(28)25-22(24-20)23-16-7-6-14-3-1-4-15(14)13-16/h6-11,13H,1-5,12H2,(H3,23,24,25,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369338 (CHEMBL1237294) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CC[C@@H]2O |r,c:3,t:8| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14,16,20H,2-5,7-9H2,1H3/t13-,14?,16-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177654 (4-(3-(2-(2,3-dihydro-1H-inden-5-ylamino)-4-hydroxy...) Show SMILES COc1cc(ccc1OCCCc1c(O)nc(Nc2ccc3CCCc3c2)[nH]c1=O)C#N Show InChI InChI=1S/C24H24N4O4/c1-31-21-12-15(14-25)7-10-20(21)32-11-3-6-19-22(29)27-24(28-23(19)30)26-18-9-8-16-4-2-5-17(16)13-18/h7-10,12-13H,2-6,11H2,1H3,(H3,26,27,28,29,30)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177644 (2-(2,3-dihydro-1H-inden-5-ylamino)-6-hydroxy-5-(3-...) Show SMILES Oc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CCCc1ccccc1 Show InChI InChI=1S/C22H23N3O2/c26-20-19(11-4-8-15-6-2-1-3-7-15)21(27)25-22(24-20)23-18-13-12-16-9-5-10-17(16)14-18/h1-3,6-7,12-14H,4-5,8-11H2,(H3,23,24,25,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177645 (2-(2,3-dihydro-1H-inden-5-ylamino)-6-hydroxy-5-(3-...) Show SMILES Oc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CCCOc1ccccc1 Show InChI InChI=1S/C22H23N3O3/c26-20-19(10-5-13-28-18-8-2-1-3-9-18)21(27)25-22(24-20)23-17-12-11-15-6-4-7-16(15)14-17/h1-3,8-9,11-12,14H,4-7,10,13H2,(H3,23,24,25,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177651 (5-benzyl-2-(3-ethyl-4-methylphenylamino)-6-hydroxy...) Show SMILES CCc1cc(Nc2nc(O)c(Cc3ccccc3)c(=O)[nH]2)ccc1C Show InChI InChI=1S/C20H21N3O2/c1-3-15-12-16(10-9-13(15)2)21-20-22-18(24)17(19(25)23-20)11-14-7-5-4-6-8-14/h4-10,12H,3,11H2,1-2H3,(H3,21,22,23,24,25)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057297 ((5aS,7aS,8S,10aS,10bS)-8-Hydroxy-7a-methyl-3,4,6,7...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CC[C@@H]2O |t:8| Show InChI InChI=1S/C17H25NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-16,20H,2-9H2,1H3/t13-,14-,15-,16-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50057292 ((5aS,7aS,10aS,10bS)-7a-Methyl-3,4,5a,6,7,7a,9,10,1...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CCN34)[C@@H]1CCC2=O |t:8| Show InChI InChI=1S/C17H23NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h10,13-15H,2-9H2,1H3/t13-,14-,15-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369336 (CHEMBL1237306) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CCC2=O |r,c:3,t:8| Show InChI InChI=1S/C17H21NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14H,2-5,7-9H2,1H3/t13-,14?,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 2 (Homo sapiens (Human))	BDBM50369336 (CHEMBL1237306) Show SMILES C[C@]12CC=C3[C@@H](CCC4=CC(=O)CCN34)C1CCC2=O |r,c:3,t:8| Show InChI InChI=1S/C17H21NO2/c1-17-8-6-15-13(14(17)4-5-16(17)20)3-2-11-10-12(19)7-9-18(11)15/h6,10,13-14H,2-5,7-9H2,1H3/t13-,14?,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against 5-alpha Reductase-2 on human prostate homogenates from surgically derived benign hyperplastic tissue				J Med Chem 40: 1112-29 (1997) Article DOI: 10.1021/jm960807v BindingDB Entry DOI: 10.7270/Q2D21Z8K
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177657 (2-(2,3-dihydro-1H-inden-5-ylamino)-6-hydroxy-5-(3-...) Show SMILES Oc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CCCOc1ccc(cn1)[N+]([O-])=O Show InChI InChI=1S/C21H21N5O5/c27-19-17(5-2-10-31-18-9-8-16(12-22-18)26(29)30)20(28)25-21(24-19)23-15-7-6-13-3-1-4-14(13)11-15/h6-9,11-12H,1-5,10H2,(H3,23,24,25,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177647 (4-(3-(2-(2,3-dihydro-1H-inden-5-ylamino)-4-hydroxy...) Show SMILES Oc1nc(Nc2ccc3CCCc3c2)[nH]c(=O)c1CCCOc1ccc(cc1)C#N Show InChI InChI=1S/C23H22N4O3/c24-14-15-6-10-19(11-7-15)30-12-2-5-20-21(28)26-23(27-22(20)29)25-18-9-8-16-3-1-4-17(16)13-18/h6-11,13H,1-5,12H2,(H3,25,26,27,28,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM50378783 (CLOFAZIMINE) Show SMILES CC(C)\N=c1/cc2n(-c3ccc(Cl)cc3)c3ccccc3nc2cc1Nc1ccc(Cl)cc1 Show InChI InChI=1S/C27H22Cl2N4/c1-17(2)30-24-16-27-25(15-23(24)31-20-11-7-18(28)8-12-20)32-22-5-3-4-6-26(22)33(27)21-13-9-19(29)10-14-21/h3-17,31H,1-2H3/b30-24+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National University of La Plata (UNLP) Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzaine in absence of 0.01% Triton				Eur J Med Chem 93: 338-48 (2015) Article DOI: 10.1016/j.ejmech.2015.01.065 BindingDB Entry DOI: 10.7270/Q2QR4ZV1
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50350995 (CHEMBL1818876) Show SMILES NC(=S)NN=Cc1ccco1 |w:5.5| Show InChI InChI=1S/C6H7N3OS/c7-6(11)9-8-4-5-2-1-3-10-5/h1-4H,(H3,7,9,11)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Grenoble/CNRS Curated by ChEMBL					Assay Description Inhibition of diphenolase activity of mushroom tyrosinase using L-DOPA as substrate preincubated for 5 mins by spectroscopic method				Eur J Med Chem 46: 4330-5 (2011) Article DOI: 10.1016/j.ejmech.2011.07.003 BindingDB Entry DOI: 10.7270/Q2SF2WKC
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50351005 (CHEMBL1818886) Show SMILES NC(=S)NN=CCc1ccccc1 |w:5.5| Show InChI InChI=1S/C9H11N3S/c10-9(13)12-11-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,10,12,13)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Grenoble/CNRS Curated by ChEMBL					Assay Description Inhibition of diphenolase activity of mushroom tyrosinase using L-DOPA as substrate preincubated for 5 mins by spectroscopic method				Eur J Med Chem 46: 4330-5 (2011) Article DOI: 10.1016/j.ejmech.2011.07.003 BindingDB Entry DOI: 10.7270/Q2SF2WKC
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177665 (5-allyl-2-(3-ethyl-4-methylphenylamino)-6-hydroxyp...) Show SMILES CCc1cc(Nc2nc(O)c(CC=C)c(=O)[nH]2)ccc1C Show InChI InChI=1S/C16H19N3O2/c1-4-6-13-14(20)18-16(19-15(13)21)17-12-8-7-10(3)11(5-2)9-12/h4,7-9H,1,5-6H2,2-3H3,(H3,17,18,19,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50350996 (CHEMBL1818877) Show SMILES NC(=S)NN=Cc1ccc[nH]1 |w:5.5| Show InChI InChI=1S/C6H8N4S/c7-6(11)10-9-4-5-2-1-3-8-5/h1-4,8H,(H3,7,10,11)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Grenoble/CNRS Curated by ChEMBL					Assay Description Inhibition of diphenolase activity of mushroom tyrosinase using L-DOPA as substrate preincubated for 5 mins by spectroscopic method				Eur J Med Chem 46: 4330-5 (2011) Article DOI: 10.1016/j.ejmech.2011.07.003 BindingDB Entry DOI: 10.7270/Q2SF2WKC
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50350993 (CHEMBL1818874) Show SMILES NC(=S)NN=Cc1cccc(F)c1 |w:5.5| Show InChI InChI=1S/C8H8FN3S/c9-7-3-1-2-6(4-7)5-11-12-8(10)13/h1-5H,(H3,10,12,13)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Grenoble/CNRS Curated by ChEMBL					Assay Description Inhibition of diphenolase activity of mushroom tyrosinase using L-DOPA as substrate preincubated for 5 mins by spectroscopic method				Eur J Med Chem 46: 4330-5 (2011) Article DOI: 10.1016/j.ejmech.2011.07.003 BindingDB Entry DOI: 10.7270/Q2SF2WKC
					More data for this Ligand-Target Pair
DNA polymerase III PolC-type (Staphylococcus aureus)	BDBM50177656 (5-(3-(4-aminophenoxy)propyl)-2-(2,3-dihydro-1H-ind...) Show SMILES Nc1ccc(OCCCc2c(O)nc(Nc3ccc4CCCc4c3)[nH]c2=O)cc1 Show InChI InChI=1S/C22H24N4O3/c23-16-7-10-18(11-8-16)29-12-2-5-19-20(27)25-22(26-21(19)28)24-17-9-6-14-3-1-4-15(14)13-17/h6-11,13H,1-5,12,23H2,(H3,24,25,26,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Targanta Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of DNA polymerase3C from Staphylococcus aureus				Bioorg Med Chem Lett 16: 891-6 (2006) Article DOI: 10.1016/j.bmcl.2005.11.009 BindingDB Entry DOI: 10.7270/Q2125S75
					More data for this Ligand-Target Pair

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