Compile Data Set for Download or QSAR

Found 104 hits with Last Name = 'smith' and Initial = 'ht'   

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
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371080 (CHEMBL376392) Show SMILES NC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1Cl Show InChI InChI=1S/C16H16ClFN4O2/c17-12-2-1-10(18)9-14(12)24-11-5-7-22(8-6-11)15-4-3-13(16(19)23)20-21-15/h1-4,9,11H,5-8H2,(H2,19,23)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371071 (CHEMBL227205) Show SMILES CNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Br Show InChI InChI=1S/C17H19BrN4O2/c1-19-17(23)14-6-7-16(21-20-14)22-10-8-12(9-11-22)24-15-5-3-2-4-13(15)18/h2-7,12H,8-11H2,1H3,(H,19,23)	PDB KEGG UniProtKB/SwissProt 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
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371087 (CHEMBL375514) Show SMILES Cc1nnc([nH]1)-c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1Cl Show InChI InChI=1S/C18H18ClFN6O/c1-11-21-18(25-22-11)15-4-5-17(24-23-15)26-8-6-13(7-9-26)27-16-10-12(20)2-3-14(16)19/h2-5,10,13H,6-9H2,1H3,(H,21,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371060 (CHEMBL226646) Show SMILES Cc1nnc(o1)-c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1Cl Show InChI InChI=1S/C18H17ClFN5O2/c1-11-21-24-18(26-11)15-4-5-17(23-22-15)25-8-6-13(7-9-25)27-16-10-12(20)2-3-14(16)19/h2-5,10,13H,6-9H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371053 (CHEMBL227256) Show SMILES CNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1Cl Show InChI InChI=1S/C17H18ClFN4O2/c1-20-17(24)14-4-5-16(22-21-14)23-8-6-12(7-9-23)25-15-10-11(19)2-3-13(15)18/h2-5,10,12H,6-9H2,1H3,(H,20,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371046 (CHEMBL427416) Show SMILES Cc1noc(n1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1C Show InChI InChI=1S/C19H21N5O2/c1-13-5-3-4-6-17(13)25-15-9-11-24(12-10-15)18-8-7-16(21-22-18)19-20-14(2)23-26-19/h3-8,15H,9-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261893 (4-(2-chloro-4-fluorophenoxy)-N-(3-(methylcarbamoyl...) Show SMILES CNC(=O)c1cccc(NC(=O)N2CCC(CC2)Oc2ccc(F)cc2Cl)c1 Show InChI InChI=1S/C20H21ClFN3O3/c1-23-19(26)13-3-2-4-15(11-13)24-20(27)25-9-7-16(8-10-25)28-18-6-5-14(22)12-17(18)21/h2-6,11-12,16H,7-10H2,1H3,(H,23,26)(H,24,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371059 (CHEMBL227313) Show SMILES COc1ccccc1OC1CCN(CC1)c1ccc(nn1)C(=O)NCCc1cnc[nH]1 Show InChI InChI=1S/C22H26N6O3/c1-30-19-4-2-3-5-20(19)31-17-9-12-28(13-10-17)21-7-6-18(26-27-21)22(29)24-11-8-16-14-23-15-25-16/h2-7,14-15,17H,8-13H2,1H3,(H,23,25)(H,24,29)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371077 (CHEMBL227255) Show SMILES CNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cc(Cl)ccc1Cl Show InChI InChI=1S/C17H18Cl2N4O2/c1-20-17(24)14-4-5-16(22-21-14)23-8-6-12(7-9-23)25-15-10-11(18)2-3-13(15)19/h2-5,10,12H,6-9H2,1H3,(H,20,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371084 (CHEMBL227257) Show SMILES NC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C16H17ClN4O2/c17-12-3-1-2-4-14(12)23-11-7-9-21(10-8-11)15-6-5-13(16(18)22)19-20-15/h1-6,11H,7-10H2,(H2,18,22)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371074 (CHEMBL388735) Show SMILES Fc1ccccc1OC1CCN(CC1)c1ccc(nn1)-c1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C24H22FN5O2/c25-19-8-4-5-9-21(19)31-18-12-14-30(15-13-18)23-11-10-20(27-28-23)24-26-22(29-32-24)16-17-6-2-1-3-7-17/h1-11,18H,12-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.40	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261949 (4-(2-chlorophenoxy)-N-(3-(ethylcarbamoyl)phenyl)pi...) Show SMILES CCNC(=O)c1cccc(NC(=O)N2CCC(CC2)Oc2ccccc2Cl)c1 Show InChI InChI=1S/C21H24ClN3O3/c1-2-23-20(26)15-6-5-7-16(14-15)24-21(27)25-12-10-17(11-13-25)28-19-9-4-3-8-18(19)22/h3-9,14,17H,2,10-13H2,1H3,(H,23,26)(H,24,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261895 (4-(2-chlorophenoxy)-N-(3-(3-methyl-1,2,4-oxadiazol...) Show SMILES Cc1noc(n1)-c1cccc(NC(=O)N2CCC(CC2)Oc2ccccc2Cl)c1 Show InChI InChI=1S/C21H21ClN4O3/c1-14-23-20(29-25-14)15-5-4-6-16(13-15)24-21(27)26-11-9-17(10-12-26)28-19-8-3-2-7-18(19)22/h2-8,13,17H,9-12H2,1H3,(H,24,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371043 (CHEMBL375265) Show SMILES CNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C17H19ClN4O2/c1-19-17(23)14-6-7-16(21-20-14)22-10-8-12(9-11-22)24-15-5-3-2-4-13(15)18/h2-7,12H,8-11H2,1H3,(H,19,23)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371073 (CHEMBL226648) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)-c1ccoc1 Show InChI InChI=1S/C19H18ClN3O2/c20-16-3-1-2-4-18(16)25-15-7-10-23(11-8-15)19-6-5-17(21-22-19)14-9-12-24-13-14/h1-6,9,12-13,15H,7-8,10-11H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261896 (CHEMBL512085 | N-(3-(1H-imidazol-2-yl)phenyl)-4-(2...) Show SMILES Clc1ccccc1OC1CCN(CC1)C(=O)Nc1cccc(c1)-c1ncc[nH]1 Show InChI InChI=1S/C21H21ClN4O2/c22-18-6-1-2-7-19(18)28-17-8-12-26(13-9-17)21(27)25-16-5-3-4-15(14-16)20-23-10-11-24-20/h1-7,10-11,14,17H,8-9,12-13H2,(H,23,24)(H,25,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261948 (CHEMBL467180 | N-(3-carbamoylphenyl)-4-(2-chloroph...) Show SMILES NC(=O)c1cccc(NC(=O)N2CCC(CC2)Oc2ccccc2Cl)c1 Show InChI InChI=1S/C19H20ClN3O3/c20-16-6-1-2-7-17(16)26-15-8-10-23(11-9-15)19(25)22-14-5-3-4-13(12-14)18(21)24/h1-7,12,15H,8-11H2,(H2,21,24)(H,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase 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
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371079 (CHEMBL442055) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)C(=O)NCCc1cccs1 Show InChI InChI=1S/C22H23ClN4O2S/c23-18-5-1-2-6-20(18)29-16-10-13-27(14-11-16)21-8-7-19(25-26-21)22(28)24-12-9-17-4-3-15-30-17/h1-8,15-16H,9-14H2,(H,24,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371058 (CHEMBL227269) Show SMILES Cc1cc(CNC(=O)c2ccc(nn2)N2CCC(CC2)Oc2ccccc2Cl)on1 Show InChI InChI=1S/C21H22ClN5O3/c1-14-12-16(30-26-14)13-23-21(28)18-6-7-20(25-24-18)27-10-8-15(9-11-27)29-19-5-3-2-4-17(19)22/h2-7,12,15H,8-11,13H2,1H3,(H,23,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371051 (CHEMBL227280) Show SMILES Cc1nc(no1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C18H18ClN5O2/c1-12-20-18(23-26-12)15-6-7-17(22-21-15)24-10-8-13(9-11-24)25-16-5-3-2-4-14(16)19/h2-7,13H,8-11H2,1H3	PDB KEGG UniProtKB/SwissProt 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
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371050 (CHEMBL376117) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)-n1cccc1 Show InChI InChI=1S/C19H19ClN4O/c20-16-5-1-2-6-17(16)25-15-9-13-24(14-10-15)19-8-7-18(21-22-19)23-11-3-4-12-23/h1-8,11-12,15H,9-10,13-14H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371048 (CHEMBL227281) Show SMILES C(c1noc(n1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1)c1ccccc1 Show InChI InChI=1S/C24H23N5O2/c1-3-7-18(8-4-1)17-22-25-24(31-28-22)21-11-12-23(27-26-21)29-15-13-20(14-16-29)30-19-9-5-2-6-10-19/h1-12,20H,13-17H2	PDB KEGG UniProtKB/SwissProt 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
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371069 (CHEMBL226597) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)-c1nnc(Cc2ccccc2)o1 Show InChI InChI=1S/C24H22ClN5O2/c25-19-8-4-5-9-21(19)31-18-12-14-30(15-13-18)22-11-10-20(26-27-22)24-29-28-23(32-24)16-17-6-2-1-3-7-17/h1-11,18H,12-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371088 (CHEMBL229271) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cccc(F)c1 Show InChI InChI=1S/C21H27FN4O2/c1-15(2)8-11-23-21(27)19-6-7-20(25-24-19)26-12-9-17(10-13-26)28-18-5-3-4-16(22)14-18/h3-7,14-15,17H,8-13H2,1-2H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371047 (CHEMBL229328) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1F Show InChI InChI=1S/C21H26F2N4O2/c1-14(2)7-10-24-21(28)18-5-6-20(26-25-18)27-11-8-16(9-12-27)29-19-13-15(22)3-4-17(19)23/h3-6,13-14,16H,7-12H2,1-2H3,(H,24,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371064 (CHEMBL227204) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cc(Cl)ccc1Cl Show InChI InChI=1S/C21H26Cl2N4O2/c1-14(2)7-10-24-21(28)18-5-6-20(26-25-18)27-11-8-16(9-12-27)29-19-13-15(22)3-4-17(19)23/h3-6,13-14,16H,7-12H2,1-2H3,(H,24,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261718 (CHEMBL466753 | N-(3-(methylcarbamoyl)phenyl)-4-(o-...) Show SMILES CNC(=O)c1cccc(NC(=O)N2CCC(CC2)Oc2ccccc2C)c1 Show InChI InChI=1S/C21H25N3O3/c1-15-6-3-4-9-19(15)27-18-10-12-24(13-11-18)21(26)23-17-8-5-7-16(14-17)20(25)22-2/h3-9,14,18H,10-13H2,1-2H3,(H,22,25)(H,23,26)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371056 (CHEMBL229327) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1cccc(F)c1F Show InChI InChI=1S/C21H26F2N4O2/c1-14(2)8-11-24-21(28)17-6-7-19(26-25-17)27-12-9-15(10-13-27)29-18-5-3-4-16(22)20(18)23/h3-7,14-15H,8-13H2,1-2H3,(H,24,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371044 (CHEMBL390518) Show SMILES Cc1noc(n1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C18H18ClN5O2/c1-12-20-18(26-23-12)15-6-7-17(22-21-15)24-10-8-13(9-11-24)25-16-5-3-2-4-14(16)19/h2-7,13H,8-11H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371054 (CHEMBL229270) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1F Show InChI InChI=1S/C21H27FN4O2/c1-15(2)9-12-23-21(27)18-7-8-20(25-24-18)26-13-10-16(11-14-26)28-19-6-4-3-5-17(19)22/h3-8,15-16H,9-14H2,1-2H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50261720 (4-(3-chlorophenoxy)-N-(3-(methylcarbamoyl)phenyl)p...) Show SMILES CNC(=O)c1cccc(NC(=O)N2CCC(CC2)Oc2cccc(Cl)c2)c1 Show InChI InChI=1S/C20H22ClN3O3/c1-22-19(25)14-4-2-6-16(12-14)23-20(26)24-10-8-17(9-11-24)27-18-7-3-5-15(21)13-18/h2-7,12-13,17H,8-11H2,1H3,(H,22,25)(H,23,26)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse SCD1				Bioorg Med Chem Lett 18: 4298-302 (2008) Article DOI: 10.1016/j.bmcl.2008.06.088 BindingDB Entry DOI: 10.7270/Q2ST7PNG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371081 (CHEMBL226702) Show SMILES Cc1nccn1-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C19H20ClN5O/c1-14-21-10-13-25(14)19-7-6-18(22-23-19)24-11-8-15(9-12-24)26-17-5-3-2-4-16(17)20/h2-7,10,13,15H,8-9,11-12H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371067 (CHEMBL375954) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C21H27ClN4O2/c1-15(2)9-12-23-21(27)18-7-8-20(25-24-18)26-13-10-16(11-14-26)28-19-6-4-3-5-17(19)22/h3-8,15-16H,9-14H2,1-2H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371065 (CHEMBL227217) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C22H22ClN5O2/c23-18-5-1-2-6-20(18)30-17-9-12-28(13-10-17)21-8-7-19(26-27-21)22(29)25-15-16-4-3-11-24-14-16/h1-8,11,14,17H,9-10,12-13,15H2,(H,25,29)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371070 (CHEMBL227282) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)-c1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C24H22ClN5O2/c25-19-8-4-5-9-21(19)31-18-12-14-30(15-13-18)23-11-10-20(27-28-23)24-26-22(29-32-24)16-17-6-2-1-3-7-17/h1-11,18H,12-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371037 (CHEMBL230609) Show SMILES Clc1ccccc1OC1CCN(CC1)C(=O)CNc1nccnc1Cl Show InChI InChI=1S/C17H18Cl2N4O2/c18-13-3-1-2-4-14(13)25-12-5-9-23(10-6-12)15(24)11-22-17-16(19)20-7-8-21-17/h1-4,7-8,12H,5-6,9-11H2,(H,21,22)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371085 (CHEMBL226701) Show SMILES Cc1cc(C)n(n1)-c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C20H22ClN5O/c1-14-13-15(2)26(24-14)20-8-7-19(22-23-20)25-11-9-16(10-12-25)27-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371062 (CHEMBL227203) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1C(F)(F)F Show InChI InChI=1S/C22H27F3N4O2/c1-15(2)9-12-26-21(30)18-7-8-20(28-27-18)29-13-10-16(11-14-29)31-19-6-4-3-5-17(19)22(23,24)25/h3-8,15-16H,9-14H2,1-2H3,(H,26,30)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371016 (CHEMBL395048) Show SMILES CNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1c(F)ccc(F)c1Cl Show InChI InChI=1S/C19H20ClF2N5O3/c1-23-19(29)16-18(25-7-6-24-16)26-10-14(28)27-8-4-11(5-9-27)30-17-13(22)3-2-12(21)15(17)20/h2-3,6-7,11H,4-5,8-10H2,1H3,(H,23,29)(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371010 (CHEMBL230823) Show SMILES CNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1c(Cl)cccc1Cl Show InChI InChI=1S/C19H21Cl2N5O3/c1-22-19(28)16-18(24-8-7-23-16)25-11-15(27)26-9-5-12(6-10-26)29-17-13(20)3-2-4-14(17)21/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,22,28)(H,24,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371021 (CHEMBL231635) Show SMILES CCNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C20H24ClN5O3/c1-2-22-20(28)18-19(24-10-9-23-18)25-13-17(27)26-11-7-14(8-12-26)29-16-6-4-3-5-15(16)21/h3-6,9-10,14H,2,7-8,11-13H2,1H3,(H,22,28)(H,24,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371022 (CHEMBL230501) Show SMILES COC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C19H21ClN4O4/c1-27-19(26)17-18(22-9-8-21-17)23-12-16(25)24-10-6-13(7-11-24)28-15-5-3-2-4-14(15)20/h2-5,8-9,13H,6-7,10-12H2,1H3,(H,22,23)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371025 (CHEMBL231534) Show SMILES CNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C19H22ClN5O3/c1-21-19(27)17-18(23-9-8-22-17)24-12-16(26)25-10-6-13(7-11-25)28-15-5-3-2-4-14(15)20/h2-5,8-9,13H,6-7,10-12H2,1H3,(H,21,27)(H,23,24)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371036 (CHEMBL395074) Show SMILES CNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1c(F)cccc1Cl Show InChI InChI=1S/C19H21ClFN5O3/c1-22-19(28)16-18(24-8-7-23-16)25-11-15(27)26-9-5-12(6-10-26)29-17-13(20)3-2-4-14(17)21/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,22,28)(H,24,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371063 (CHEMBL227258) Show SMILES OCCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1Cl Show InChI InChI=1S/C18H21ClN4O3/c19-14-3-1-2-4-16(14)26-13-7-10-23(11-8-13)17-6-5-15(21-22-17)18(25)20-9-12-24/h1-6,13,24H,7-12H2,(H,20,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50371039 (CHEMBL230821) Show SMILES CNC(=O)c1nccnc1NCC(=O)N1CCC(CC1)Oc1ccccc1Br Show InChI InChI=1S/C19H22BrN5O3/c1-21-19(27)17-18(23-9-8-22-17)24-12-16(26)25-10-6-13(7-11-25)28-15-5-3-2-4-14(15)20/h2-5,8-9,13H,6-7,10-12H2,1H3,(H,21,27)(H,23,24)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 17: 3388-91 (2007) Article DOI: 10.1016/j.bmcl.2007.03.099 BindingDB Entry DOI: 10.7270/Q20K29DB
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371040 (CHEMBL226691) Show SMILES Clc1ccccc1OC1CCN(CC1)c1ccc(nn1)C(=O)NCc1ncc[nH]1 Show InChI InChI=1S/C20H21ClN6O2/c21-15-3-1-2-4-17(15)29-14-7-11-27(12-8-14)19-6-5-16(25-26-19)20(28)24-13-18-22-9-10-23-18/h1-6,9-10,14H,7-8,11-13H2,(H,22,23)(H,24,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371075 (CHEMBL390818) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccccc1 Show InChI InChI=1S/C21H28N4O2/c1-16(2)10-13-22-21(26)19-8-9-20(24-23-19)25-14-11-18(12-15-25)27-17-6-4-3-5-7-17/h3-9,16,18H,10-15H2,1-2H3,(H,22,26)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371041 (CHEMBL229326) Show SMILES CC(C)CCNC(=O)c1ccc(nn1)N1CCC(CC1)Oc1ccc(F)cc1 Show InChI InChI=1S/C21H27FN4O2/c1-15(2)9-12-23-21(27)19-7-8-20(25-24-19)26-13-10-18(11-14-26)28-17-5-3-16(22)4-6-17/h3-8,15,18H,9-14H2,1-2H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371078 (CHEMBL227270) Show SMILES Cc1cc(CNC(=O)c2ccc(nn2)N2CCC(CC2)Oc2ccccc2Cl)[nH]n1 Show InChI InChI=1S/C21H23ClN6O2/c1-14-12-15(25-24-14)13-23-21(29)18-6-7-20(27-26-18)28-10-8-16(9-11-28)30-19-5-3-2-4-17(19)22/h2-7,12,16H,8-11,13H2,1H3,(H,23,29)(H,24,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
					More data for this Ligand-Target Pair

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