Compile Data Set for Download or QSAR

Found 31 hits Enz. Inhib. hit(s) with all data for entry = 50001589   

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
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016653 (CHEMBL19187 | N-Benzyl-4-chloro-2-(2,5-dioxo-imida...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCc1ccccc1 Show InChI InChI=1S/C16H14ClN3O4S/c17-11-6-7-13(12(8-11)14-15(21)20-16(22)19-14)25(23,24)18-9-10-4-2-1-3-5-10/h1-8,18,21H,9H2,(H2,19,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016646 (5-[5-Chloro-2-(pentane-1-sulfonyl)-phenyl]-imidazo...) Show SMILES CCCCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C14H17ClN2O4S/c1-2-3-4-7-22(20,21)11-6-5-9(15)8-10(11)12-13(18)17-14(19)16-12/h5-6,8,18H,2-4,7H2,1H3,(H2,16,17,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016634 (5-(5-Chloro-2-methanesulfonyl-phenyl)-imidazolidin...) Show SMILES CS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9ClN2O4S/c1-18(16,17)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016629 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(3-phen...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCCc1ccccc1 Show InChI InChI=1S/C18H18ClN3O4S/c19-13-8-9-15(14(11-13)16-17(23)22-18(24)21-16)27(25,26)20-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,20,23H,4,7,10H2,(H2,21,22,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM16312 ((4S)-6-fluoro-2,3-dihydrospiro[1-benzopyran-4,4'-i...) Show SMILES Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1 |r| Show InChI InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)/t11-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016640 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-methyl-...) Show SMILES CNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H10ClN3O4S/c1-12-19(17,18)7-3-2-5(11)4-6(7)8-9(15)14-10(16)13-8/h2-4,12,15H,1H3,(H2,13,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016642 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-benzenesu...) Show SMILES NS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C9H8ClN3O4S/c10-4-1-2-6(18(11,16)17)5(3-4)7-8(14)13-9(15)12-7/h1-3,14H,(H2,11,16,17)(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016644 (5-(5-Chloro-2-ethanesulfonyl-phenyl)-imidazolidine...) Show SMILES CCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C11H11ClN2O4S/c1-2-19(17,18)8-4-3-6(12)5-7(8)9-10(15)14-11(16)13-9/h3-5,15H,2H2,1H3,(H2,13,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016633 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-pentyl-...) Show SMILES CCCCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C14H18ClN3O4S/c1-2-3-4-7-16-23(21,22)11-6-5-9(15)8-10(11)12-13(19)18-14(20)17-12/h5-6,8,16,19H,2-4,7H2,1H3,(H2,17,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016652 (5-{5-Chloro-2-[2-(4-chloro-phenyl)-ethanesulfonyl]...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)CCc1ccc(Cl)cc1 Show InChI InChI=1S/C17H14Cl2N2O4S/c18-11-3-1-10(2-4-11)7-8-26(24,25)14-6-5-12(19)9-13(14)15-16(22)21-17(23)20-15/h1-6,9,22H,7-8H2,(H2,20,21,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016632 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(4-fluo...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)Nc1ccc(F)cc1 Show InChI InChI=1S/C15H11ClFN3O4S/c16-8-1-6-12(11(7-8)13-14(21)19-15(22)18-13)25(23,24)20-10-4-2-9(17)3-5-10/h1-7,20-21H,(H2,18,19,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016630 (5-[5-Chloro-2-(hexane-1-sulfonyl)-phenyl]-imidazol...) Show SMILES CCCCCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C15H19ClN2O4S/c1-2-3-4-5-8-23(21,22)12-7-6-10(16)9-11(12)13-14(19)18-15(20)17-13/h6-7,9,19H,2-5,8H2,1H3,(H2,17,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016631 (5-(5-Chloro-2-methanesulfinyl-phenyl)-imidazolidin...) Show SMILES CS(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9ClN2O3S/c1-17(16)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016638 (5-[5-Chloro-2-(propane-1-sulfonyl)-phenyl]-imidazo...) Show SMILES CCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C12H13ClN2O4S/c1-2-5-20(18,19)9-4-3-7(13)6-8(9)10-11(16)15-12(17)14-10/h3-4,6,16H,2,5H2,1H3,(H2,14,15,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016637 (5-(5-Chloro-2-methanesulfonyl-3-methyl-phenyl)-imi...) Show SMILES Cc1cc(Cl)cc(-c2[nH]c(=O)[nH]c2O)c1S(C)(=O)=O Show InChI InChI=1S/C11H11ClN2O4S/c1-5-3-6(12)4-7(9(5)19(2,17)18)8-10(15)14-11(16)13-8/h3-4,15H,1-2H3,(H2,13,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016645 (5-[5-Chloro-2-(4-chloro-phenylmethanesulfonyl)-phe...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C16H12Cl2N2O4S/c17-10-3-1-9(2-4-10)8-25(23,24)13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016655 (5-[5-Chloro-2-(propane-2-sulfonyl)-phenyl]-imidazo...) Show SMILES CC(C)S(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C12H13ClN2O4S/c1-6(2)20(18,19)9-4-3-7(13)5-8(9)10-11(16)15-12(17)14-10/h3-6,16H,1-2H3,(H2,14,15,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016635 (5-[5-Chloro-2-(4-chloro-phenylmethanesulfinyl)-phe...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C16H12Cl2N2O3S/c17-10-3-1-9(2-4-10)8-24(23)13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM16312 ((4S)-6-fluoro-2,3-dihydrospiro[1-benzopyran-4,4'-i...) Show SMILES Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1 |r| Show InChI InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)/t11-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibitory activity of the compound was determined against human placental aldose reductase (HPAR) with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016647 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-propyl-...) Show SMILES CCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C12H14ClN3O4S/c1-2-5-14-21(19,20)9-4-3-7(13)6-8(9)10-11(17)16-12(18)15-10/h3-4,6,14,17H,2,5H2,1H3,(H2,15,16,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016641 (5-(5-Chloro-2-methanesulfonyl-3-trifluoromethyl-ph...) Show SMILES CS(=O)(=O)c1c(cc(Cl)cc1C(F)(F)F)-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C11H8ClF3N2O4S/c1-22(20,21)8-5(7-9(18)17-10(19)16-7)2-4(12)3-6(8)11(13,14)15/h2-3,18H,1H3,(H2,16,17,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016628 (5-(5-Fluoro-2-methanesulfonyl-phenyl)-imidazolidin...) Show SMILES CS(=O)(=O)c1ccc(F)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9FN2O4S/c1-18(16,17)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016656 (5-(3,5-Dichloro-2-methanesulfonyl-phenyl)-imidazol...) Show SMILES CS(=O)(=O)c1c(Cl)cc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H8Cl2N2O4S/c1-19(17,18)8-5(2-4(11)3-6(8)12)7-9(15)14-10(16)13-7/h2-3,15H,1H3,(H2,13,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016649 (5-(5-Chloro-2-methylsulfanyl-phenyl)-imidazolidine...) Show SMILES CSc1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9ClN2O2S/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016654 (CHEMBL19064 | N-Butyl-4-chloro-2-(2,5-dioxo-imidaz...) Show SMILES CCCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C13H16ClN3O4S/c1-2-3-6-15-22(20,21)10-5-4-8(14)7-9(10)11-12(18)17-13(19)16-11/h4-5,7,15,18H,2-3,6H2,1H3,(H2,16,17,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016648 (5-[5-Chloro-2-(4-chloro-benzylsulfanyl)-phenyl]-im...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1SCc1ccc(Cl)cc1 Show InChI InChI=1S/C16H12Cl2N2O2S/c17-10-3-1-9(2-4-10)8-23-13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016650 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-pheneth...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCc1ccccc1 Show InChI InChI=1S/C17H16ClN3O4S/c18-12-6-7-14(13(10-12)15-16(22)21-17(23)20-15)26(24,25)19-9-8-11-4-2-1-3-5-11/h1-7,10,19,22H,8-9H2,(H2,20,21,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016639 (5-(5-Chloro-2-methoxy-phenyl)-imidazolidine-2,4-di...) Show SMILES COc1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9ClN2O3/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016636 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N,N-dimet...) Show SMILES CN(C)S(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C11H12ClN3O4S/c1-15(2)20(18,19)8-4-3-6(12)5-7(8)9-10(16)14-11(17)13-9/h3-5,16H,1-2H3,(H2,13,14,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016651 (4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(4-phen...) Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCCCc1ccccc1 Show InChI InChI=1S/C19H20ClN3O4S/c20-14-9-10-16(15(12-14)17-18(24)23-19(25)22-17)28(26,27)21-11-5-4-8-13-6-2-1-3-7-13/h1-3,6-7,9-10,12,21,24H,4-5,8,11H2,(H2,22,23,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM50016643 (5-(5-Fluoro-2-methoxy-phenyl)-imidazolidine-2,4-di...) Show SMILES COc1ccc(F)cc1-c1[nH]c(=O)[nH]c1O Show InChI InChI=1S/C10H9FN2O3/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	7.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate				J Med Chem 32: 1208-13 (1989) BindingDB Entry DOI: 10.7270/Q24B309G
					More data for this Ligand-Target Pair