Compile Data Set for Download or QSAR

Found 82 hits with Last Name = 'mohapatra' and Initial = 's'   

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
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210089 ((R)-2-(8-methoxymethyl-benzo[1,2-b;4,5-b']difuran-...) Show SMILES COCc1c2ccoc2c(C[C@@H](C)N)c2ccoc12 Show InChI InChI=1S/C15H17NO3/c1-9(16)7-12-10-3-5-19-15(10)13(8-17-2)11-4-6-18-14(11)12/h3-6,9H,7-8,16H2,1-2H3/t9-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210078 ((R)-2-(8-methoxymethyl-2,3,6,7-tetrahydro-benzo[1,...) Show SMILES COCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12 Show InChI InChI=1S/C15H21NO3/c1-9(16)7-12-10-3-5-19-15(10)13(8-17-2)11-4-6-18-14(11)12/h9H,3-8,16H2,1-2H3/t9-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.280	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210083 (CHEMBL232995 | [8-((R)-2-amino-propyl)-2,3,6,7-tet...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(COCC(=O)Oc2ccccc2)c2CCOc12 Show InChI InChI=1S/C22H25NO5/c1-14(23)11-18-16-7-9-27-22(16)19(17-8-10-26-21(17)18)12-25-13-20(24)28-15-5-3-2-4-6-15/h2-6,14H,7-13,23H2,1H3/t14-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.290	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50052337 (2-(8-bromo-2,3,6,7-tetrahydro-benzo[1,2-b;4,5-b']d...) Show SMILES CC(N)Cc1c2CCOc2c(Br)c2CCOc12 Show InChI InChI=1S/C13H16BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h7H,2-6,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210093 (CHEMBL393077 | [8-((R)-2-amino-propyl)-benzo[1,2-b...) Show SMILES C[C@@H](N)Cc1c2ccoc2c(CO)c2ccoc12 Show InChI InChI=1S/C14H15NO3/c1-8(15)6-11-9-2-4-18-14(9)12(7-16)10-3-5-17-13(10)11/h2-5,8,16H,6-7,15H2,1H3/t8-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.310	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210084 ((R)-1-methyl-2-[8-(3-methyl-[1,2,4]oxadiazol-5-ylm...) Show SMILES C[C@@H](N)Cc1c2ccoc2c(Cc2nc(C)no2)c2ccoc12 Show InChI InChI=1S/C17H17N3O3/c1-9(18)7-13-11-3-5-22-17(11)14(12-4-6-21-16(12)13)8-15-19-10(2)20-23-15/h3-6,9H,7-8,18H2,1-2H3/t9-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.380	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50133231 ((R)-1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amine |...) Show SMILES COc1cc(C[C@@H](C)N)c(OC)cc1I Show InChI InChI=1S/C11H16INO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3/t7-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.460	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210081 ((1R,2R)-2-amino-1-(8-bromo-2,3,6,7-tetrahydro-benz...) Show SMILES C[C@@H](N)[C@H](O)c1c2CCOc2c(Br)c2CCOc12 Show InChI InChI=1S/C13H16BrNO3/c1-6(15)11(16)9-7-2-4-18-13(7)10(14)8-3-5-17-12(8)9/h6,11,16H,2-5,15H2,1H3/t6-,11+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210092 (3-[8-((R)-2-amino-propyl)-2,3,6,7-tetrahydro-benzo...) Show SMILES COC(=O)CCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12 Show InChI InChI=1S/C17H23NO4/c1-10(18)9-14-13-6-8-21-16(13)11(3-4-15(19)20-2)12-5-7-22-17(12)14/h10H,3-9,18H2,1-2H3/t10-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.860	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210079 ((R)-2-[8-(2-methoxy-ethoxymethyl)-2,3,6,7-tetrahyd...) Show SMILES COCCOCc1c2CCOc2c(C[C@@H](C)N)c2CCOc12 Show InChI InChI=1S/C17H25NO4/c1-11(18)9-14-12-3-5-22-17(12)15(10-20-8-7-19-2)13-4-6-21-16(13)14/h11H,3-10,18H2,1-2H3/t11-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.880	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210088 ((R)-1-methyl-2-{8-[2-(3-methyl-[1,2,4]oxadiazol-5-...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(CCc2nc(C)no2)c2CCOc12 Show InChI InChI=1S/C18H23N3O3/c1-10(19)9-15-14-6-8-22-17(14)12(13-5-7-23-18(13)15)3-4-16-20-11(2)21-24-16/h10H,3-9,19H2,1-2H3/t10-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210087 (CHEMBL394664 | [8-((R)-2-amino-propyl)-2,3,6,7-tet...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(CO)c2CCOc12 Show InChI InChI=1S/C14H19NO3/c1-8(15)6-11-9-2-4-18-14(9)12(7-16)10-3-5-17-13(10)11/h8,16H,2-7,15H2,1H3/t8-/m1/s1	PDB Reactome pathway 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
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210085 ((R)-1-methyl-2-[8-(3-methyl-[1,2,4]oxadiazol-5-ylm...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(Cc2nc(C)no2)c2CCOc12 Show InChI InChI=1S/C17H21N3O3/c1-9(18)7-13-11-3-5-22-17(11)14(12-4-6-21-16(12)13)8-15-19-10(2)20-23-15/h9H,3-8,18H2,1-2H3/t9-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210091 ((1S,2R)-2-amino-1-(8-bromo-2,3,6,7-tetrahydro-benz...) Show SMILES C[C@@H](N)[C@@H](O)c1c2CCOc2c(Br)c2CCOc12 Show InChI InChI=1S/C13H16BrNO3/c1-6(15)11(16)9-7-2-4-18-13(7)10(14)8-3-5-17-12(8)9/h6,11,16H,2-5,15H2,1H3/t6-,11-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM25737 (12-[(adamantan-1-ylcarbamoyl)amino]dodecanoic acid...) Show SMILES OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:25:20:27:24.23.26,25:24:20.21.19:27,THB:23:22:19:24.25.26,23:24:19:22.21.27| Show InChI InChI=1S/C23H40N2O3/c26-21(27)10-8-6-4-2-1-3-5-7-9-11-24-22(28)25-23-15-18-12-19(16-23)14-20(13-18)17-23/h18-20H,1-17H2,(H,26,27)(H2,24,25,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057466 (CHEMBL3322807 | US9127027, 13 | US9422318, 13) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1ccccc1O Show InChI InChI=1S/C23H38N2O2S/c1-2-3-13-18-24-23(27)25-19-14-9-7-5-4-6-8-10-15-20-28-22-17-12-11-16-21(22)26/h4-5,11-12,16-17,26H,2-3,6-10,13-15,18-20H2,1H3,(H2,24,25,27)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057625 (CHEMBL3322818 | US9127027, 25 | US9422318, 25) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC1=NOS(=O)N1 |t:21| Show InChI InChI=1S/C19H36N4O3S/c1-2-3-13-16-20-19(24)21-17-14-11-9-7-5-4-6-8-10-12-15-18-22-26-27(25)23-18/h5,7H,2-4,6,8-17H2,1H3,(H,22,23)(H2,20,21,24)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057474 (CHEMBL3322808 | US9127027, 14 | US9422318, 14) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCS(=O)(=O)c1ccccc1O Show InChI InChI=1S/C23H38N2O4S/c1-2-3-13-18-24-23(27)25-19-14-9-7-5-4-6-8-10-15-20-30(28,29)22-17-12-11-16-21(22)26/h4-5,11-12,16-17,26H,2-3,6-10,13-15,18-20H2,1H3,(H2,24,25,27)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057494 (CHEMBL3322814 | US9127027, 20 | US9127027, LGK-I-1...) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1nnn[nH]1 Show InChI InChI=1S/C19H36N6O/c1-2-3-13-16-20-19(26)21-17-14-11-9-7-5-4-6-8-10-12-15-18-22-24-25-23-18/h5,7H,2-4,6,8-17H2,1H3,(H2,20,21,26)(H,22,23,24,25)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210080 (8-((R)-2-amino-propyl)-2,3,6,7-tetrahydro-benzo[1,...) Show SMILES COC(=O)c1c2CCOc2c(C[C@@H](C)N)c2CCOc12 Show InChI InChI=1S/C15H19NO4/c1-8(16)7-11-9-3-5-20-14(9)12(15(17)18-2)10-4-6-19-13(10)11/h8H,3-7,16H2,1-2H3/t8-/m1/s1	PDB Reactome pathway 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
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057480 (CHEMBL3322809 | US9127027, 15 | US9422318, 15) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1nnn[nH]1 Show InChI InChI=1S/C18H34N6OS/c1-2-3-11-14-19-17(25)20-15-12-9-7-5-4-6-8-10-13-16-26-18-21-23-24-22-18/h4-5H,2-3,6-16H2,1H3,(H2,19,20,25)(H,21,22,23,24)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057491 (CHEMBL3322812 | US9127027, 18 | US9422318, 18) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCS(=O)(=O)c1ncn[nH]1 Show InChI InChI=1S/C19H35N5O3S/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-28(26,27)19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057633 (CHEMBL3322821 | US9127027, 28 | US9422318, 28) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1 Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(27)26-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,27)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057497 (CHEMBL3322815 | US9127027, 22 | US9422318, 22) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCCc1nnn[nH]1 Show InChI InChI=1S/C20H38N6O/c1-2-3-14-17-21-20(27)22-18-15-12-10-8-6-4-5-7-9-11-13-16-19-23-25-26-24-19/h6,8H,2-5,7,9-18H2,1H3,(H2,21,22,27)(H,23,24,25,26)/b8-6-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057481 (CHEMBL3322810 | US9127027, 16 | US9422318, 16) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1ncn[nH]1 Show InChI InChI=1S/C19H35N5OS/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-26-19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057450 (CHEMBL3322804 | US9127027, 12 | US9422318, 12) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCNS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C23H39N3O3S/c1-2-3-14-19-24-23(27)25-20-15-9-7-5-4-6-8-10-16-21-26-30(28,29)22-17-12-11-13-18-22/h4-5,11-13,17-18,26H,2-3,6-10,14-16,19-21H2,1H3,(H2,24,25,27)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057445 (CHEMBL3322802 | US9127027, 8 | US9422318, 8) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)NS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H41N3O4S/c1-2-3-16-21-26-25(30)27-22-17-11-9-7-5-4-6-8-10-15-20-24(29)28-33(31,32)23-18-13-12-14-19-23/h5,7,12-14,18-19H,2-4,6,8-11,15-17,20-22H2,1H3,(H,28,29)(H2,26,27,30)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057461 (CHEMBL3322806) Show SMILES [Na+].CCCCCNC(=O)NCCCC\C=C/CCCCCCS([O-])(=O)=O Show InChI InChI=1S/C18H36N2O4S.Na/c1-2-3-12-15-19-18(21)20-16-13-10-8-6-4-5-7-9-11-14-17-25(22,23)24;/h4,6H,2-3,5,7-17H2,1H3,(H2,19,20,21)(H,22,23,24);/q;+1/p-1/b6-4-;	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057635 (CHEMBL3322823 | US9127027, 24 | US9422318, 24) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCC1SC(=O)NC1=O Show InChI InChI=1S/C20H35N3O3S/c1-2-3-12-15-21-19(25)22-16-13-10-8-6-4-5-7-9-11-14-17-18(24)23-20(26)27-17/h4,6,17H,2-3,5,7-16H2,1H3,(H2,21,22,25)(H,23,24,26)/b6-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057506 (CHEMBL3322817 | US9127027, 23 | US9422318, 23) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=O)[nH]1 Show InChI InChI=1S/C20H36N4O3/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(26)27-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,26)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057446 (CHEMBL3322803 | US9127027, 9 | US9422318, 9) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)NS(C)(=O)=O Show InChI InChI=1S/C20H39N3O4S/c1-3-4-14-17-21-20(25)22-18-15-12-10-8-6-5-7-9-11-13-16-19(24)23-28(2,26)27/h6,8H,3-5,7,9-18H2,1-2H3,(H,23,24)(H2,21,22,25)/b8-6-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057488 (CHEMBL3322811) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCC[S+]([O-])c1ncn[nH]1 Show InChI InChI=1S/C19H35N5O2S/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-27(26)19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210090 (CHEMBL232997 | [8-((R)-2-amino-propyl)-2,3,6,7-tet...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(CC(O)=O)c2CCOc12 Show InChI InChI=1S/C15H19NO4/c1-8(16)6-11-9-2-4-20-15(9)12(7-13(17)18)10-3-5-19-14(10)11/h8H,2-7,16H2,1H3,(H,17,18)/t8-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	104	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057634 (CHEMBL3322822 | US9127027, 29 | US9422318, 29) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1nsc(=O)[nH]1 Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(26)27-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,26)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	231	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057420 (CHEMBL3322797 | US9127027, 2 | US9422318, 2) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)OCCOCCOCCO Show InChI InChI=1S/C25H48N2O6/c1-2-3-13-16-26-25(30)27-17-14-11-9-7-5-4-6-8-10-12-15-24(29)33-23-22-32-21-20-31-19-18-28/h5,7,28H,2-4,6,8-23H2,1H3,(H2,26,27,30)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	255	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057636 (CHEMBL3322824 | US9127027, 33) Show SMILES CCCCCNC(=O)NCCCC\C=C/CCOc1cccc2sc(NC(C)=O)nc12 Show InChI InChI=1S/C23H34N4O3S/c1-3-4-9-15-24-22(29)25-16-10-7-5-6-8-11-17-30-19-13-12-14-20-21(19)27-23(31-20)26-18(2)28/h6,8,12-14H,3-5,7,9-11,15-17H2,1-2H3,(H2,24,25,29)(H,26,27,28)/b8-6-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	282	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057427 (CHEMBL3322801) Show SMILES [Na+].[Na+].CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)N[C@@H](CC([O-])=O)C([O-])=O |r| Show InChI InChI=1S/C23H41N3O6/c1-2-3-13-16-24-23(32)25-17-14-11-9-7-5-4-6-8-10-12-15-20(27)26-19(22(30)31)18-21(28)29/h5,7,19H,2-4,6,8-18H2,1H3,(H,26,27)(H,28,29)(H,30,31)(H2,24,25,32)/p-2/b7-5-/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	392	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057419 (CHEMBL3322796 | US9422318, 1) Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC(=O)OCCOCCOCCO)C(C)C Show InChI InChI=1S/C29H55NO6/c1-4-5-6-15-18-28(32)30(27(2)3)20-17-14-12-10-8-7-9-11-13-16-19-29(33)36-26-25-35-24-23-34-22-21-31/h8,10,27,31H,4-7,9,11-26H2,1-3H3/b10-8-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057421 (CHEMBL3322798 | US9127027, 3 | US9422318, 3) Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCC(=O)OCCOCCOCCO Show InChI InChI=1S/C25H46N2O7/c1-2-3-15-26-24(30)25(31)27-16-13-11-9-7-5-4-6-8-10-12-14-23(29)34-22-21-33-20-19-32-18-17-28/h5,7,28H,2-4,6,8-22H2,1H3,(H,26,30)(H,27,31)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057422 (CHEMBL3322799 | US9422318, 5) Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC(=O)NCC(O)=O)C(C)C Show InChI InChI=1S/C25H46N2O4/c1-4-5-6-16-19-24(29)27(22(2)3)20-17-14-12-10-8-7-9-11-13-15-18-23(28)26-21-25(30)31/h8,10,22H,4-7,9,11-21H2,1-3H3,(H,26,28)(H,30,31)/b10-8-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057423 (CHEMBL3322800 | US9127027, 6 | US9422318, 6) Show SMILES CCCCCN(C)C(=O)N(C)CCCC\C=C/CCCCCCC(=O)NCC(O)=O Show InChI InChI=1S/C23H43N3O4/c1-4-5-15-18-25(2)23(30)26(3)19-16-13-11-9-7-6-8-10-12-14-17-21(27)24-20-22(28)29/h7,9H,4-6,8,10-20H2,1-3H3,(H,24,27)(H,28,29)/b9-7-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057455 (CHEMBL3322805) Show SMILES [Na+].[Na+].CCCCCNC(=O)NCCCC\C=C/CCCCCCP([O-])([O-])=O Show InChI InChI=1S/C18H37N2O4P.2Na/c1-2-3-12-15-19-18(21)20-16-13-10-8-6-4-5-7-9-11-14-17-25(22,23)24;;/h4,6H,2-3,5,7-17H2,1H3,(H2,19,20,21)(H2,22,23,24);;/q;2*+1/p-2/b6-4-;;	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057493 (CHEMBL3322813 | US9422318, 19) Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCc1nnn[nH]1)C(C)C Show InChI InChI=1S/C23H43N5O/c1-4-5-6-16-19-23(29)28(21(2)3)20-17-14-12-10-8-7-9-11-13-15-18-22-24-26-27-25-22/h8,10,21H,4-7,9,11-20H2,1-3H3,(H,24,25,26,27)/b10-8-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057502 (CHEMBL3322816 | US9127027, 21 | US9422318, 21) Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCc1nnn[nH]1 Show InChI InChI=1S/C19H34N6O2/c1-2-3-15-20-18(26)19(27)21-16-13-11-9-7-5-4-6-8-10-12-14-17-22-24-25-23-17/h5,7H,2-4,6,8-16H2,1H3,(H,20,26)(H,21,27)(H,22,23,24,25)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057630 (CHEMBL3322819 | US9127027, SRD-I-71-9 | US9422318,...) Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC1=NOS(=O)N1)C(C)C |t:21| Show InChI InChI=1S/C23H43N3O3S/c1-4-5-6-16-19-23(27)26(21(2)3)20-17-14-12-10-8-7-9-11-13-15-18-22-24-29-30(28)25-22/h8,10,21H,4-7,9,11-20H2,1-3H3,(H,24,25)/b10-8-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057632 (CHEMBL3322820) Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1 Show InChI InChI=1S/C20H34N4O3S/c1-2-3-15-21-18(25)19(26)22-16-13-11-9-7-5-4-6-8-10-12-14-17-23-20(28)27-24-17/h5,7H,2-4,6,8-16H2,1H3,(H,21,25)(H,22,26)(H,23,24,28)/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057637 (CHEMBL3322825 | US9422318, 30) Show SMILES CCCCCCC(=O)N(CCCCCOc1cccc2sc(NC(C)=O)nc12)C(C)C Show InChI InChI=1S/C24H37N3O3S/c1-5-6-7-9-15-22(29)27(18(2)3)16-10-8-11-17-30-20-13-12-14-21-23(20)26-24(31-21)25-19(4)28/h12-14,18H,5-11,15-17H2,1-4H3,(H,25,26,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057638 (CHEMBL3322826 | US9127027, 31 | US9422318, 31) Show SMILES CCCCCNC(=O)NCCCCCOc1cccc2sc(NC(C)=O)nc12 Show InChI InChI=1S/C20H30N4O3S/c1-3-4-6-12-21-19(26)22-13-7-5-8-14-27-16-10-9-11-17-18(16)24-20(28-17)23-15(2)25/h9-11H,3-8,12-14H2,1-2H3,(H2,21,22,26)(H,23,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50057639 (CHEMBL3322827 | US9127027, 32 | US9422318, 32) Show SMILES CCCCNC(=O)C(=O)NCCCCCOc1cccc2sc(NC(C)=O)nc12 Show InChI InChI=1S/C20H28N4O4S/c1-3-4-11-21-18(26)19(27)22-12-6-5-7-13-28-15-9-8-10-16-17(15)24-20(29-16)23-14(2)25/h8-10H,3-7,11-13H2,1-2H3,(H,21,26)(H,22,27)(H,23,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using CMNPC substrate by fluoresecent-based assay				J Med Chem 57: 6965-72 (2014) Article DOI: 10.1021/jm500262m BindingDB Entry DOI: 10.7270/Q2W37XZ3
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50210086 ((R)-1-methyl-2-[8-(3-methyl-[1,2,4]oxadiazol-5-yl)...) Show SMILES C[C@@H](N)Cc1c2CCOc2c(-c2nc(C)no2)c2CCOc12 Show InChI InChI=1S/C16H19N3O3/c1-8(17)7-12-10-3-5-21-15(10)13(11-4-6-20-14(11)12)16-18-9(2)19-22-16/h8H,3-7,17H2,1-2H3/t8-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd Curated by ChEMBL					Assay Description Displacement of [125I]DOI from 5HT2A receptor in rat cerebral cortex				Bioorg Med Chem Lett 17: 2998-3002 (2007) Article DOI: 10.1016/j.bmcl.2007.03.073 BindingDB Entry DOI: 10.7270/Q2KS6R7B
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 82 total )  |  Next  |  Last  >>

Jump to: