Compile Data Set for Download or QSAR

Found 47 hits with Last Name = 'iriepa-canalda' and Initial = 'i'   

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 3A/3B (Rattus norvegicus-RAT)	BDBM50167011 (4-(4-Methyl-piperazin-1-yl)-2,3-dihydro-1H-cyclope...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2CCCc12 Show InChI InChI=1S/C17H21N3/c1-19-9-11-20(12-10-19)17-15-7-4-6-13(15)14-5-2-3-8-16(14)18-17/h2-3,5,8H,4,6-7,9-12H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0708	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50063263 (6-(4-Methyl-piperazin-1-yl)-7,8,9,10-tetrahydro-ph...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2CCCCc12 Show InChI InChI=1S/C18H23N3/c1-20-10-12-21(13-11-20)18-16-8-3-2-6-14(16)15-7-4-5-9-17(15)19-18/h4-5,7,9H,2-3,6,8,10-13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0977	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50063264 (6-Piperazin-1-yl-7,8,9,10-tetrahydro-phenanthridin...) Show SMILES C1CCc2c(C1)c(nc1ccccc21)N1CCNCC1 Show InChI InChI=1S/C17H21N3/c1-2-7-15-13(5-1)14-6-3-4-8-16(14)19-17(15)20-11-9-18-10-12-20/h3-4,6,8,18H,1-2,5,7,9-12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471510 (CHEMBL294083) Show SMILES Clc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1 Show InChI InChI=1S/C18H19ClN4/c19-15-6-7-17-16(12-15)21-18(22-10-8-20-9-11-22)23(17)13-14-4-2-1-3-5-14/h1-7,12,20H,8-11,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471501 (CHEMBL62692) Show SMILES Oc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1 Show InChI InChI=1S/C18H20N4O/c23-15-6-7-17-16(12-15)20-18(21-10-8-19-9-11-21)22(17)13-14-4-2-1-3-5-14/h1-7,12,19,23H,8-11,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471508 (CHEMBL63025) Show SMILES Fc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1 Show InChI InChI=1S/C18H19FN4/c19-15-6-7-17-16(12-15)21-18(22-10-8-20-9-11-22)23(17)13-14-4-2-1-3-5-14/h1-7,12,20H,8-11,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471511 (CHEMBL294109) Show SMILES COc1cccc2nc(N3CCNCC3)n(Cc3ccccc3)c12 Show InChI InChI=1S/C19H22N4O/c1-24-17-9-5-8-16-18(17)23(14-15-6-3-2-4-7-15)19(21-16)22-12-10-20-11-13-22/h2-9,20H,10-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471660 (CHEMBL62451) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2CCSCc12 Show InChI InChI=1S/C17H21N3S/c1-19-7-9-20(10-8-19)17-15-12-21-11-6-13(15)14-4-2-3-5-16(14)18-17/h2-5H,6-12H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471659 (CHEMBL62452) Show SMILES CCc1c(C)c(nc2ccccc12)N1CCN(C)CC1 Show InChI InChI=1S/C17H23N3/c1-4-14-13(2)17(20-11-9-19(3)10-12-20)18-16-8-6-5-7-15(14)16/h5-8H,4,9-12H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50103072 (1-Benzyl-2-piperazin-1-yl-1H-benzoimidazole | CHEM...) Show SMILES C(c1ccccc1)n1c(nc2ccccc12)N1CCNCC1 Show InChI InChI=1S/C18H20N4/c1-2-6-15(7-3-1)14-22-17-9-5-4-8-16(17)20-18(22)21-12-10-19-11-13-21/h1-9,19H,10-14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	0.631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471500 (CHEMBL59689) Show SMILES Oc1ccc2nc(N3CCNCC3)n(Cc3ccccc3)c2c1 Show InChI InChI=1S/C18H20N4O/c23-15-6-7-16-17(12-15)22(13-14-4-2-1-3-5-14)18(20-16)21-10-8-19-9-11-21/h1-7,12,19,23H,8-11,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471504 (CHEMBL294522) Show SMILES Cc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1 Show InChI InChI=1S/C19H22N4/c1-15-7-8-18-17(13-15)21-19(22-11-9-20-10-12-22)23(18)14-16-5-3-2-4-6-16/h2-8,13,20H,9-12,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471503 (CHEMBL60102) Show SMILES C1CC1n1c(nc2ccccc12)N1CCNCC1 Show InChI InChI=1S/C14H18N4/c1-2-4-13-12(3-1)16-14(18(13)11-5-6-11)17-9-7-15-8-10-17/h1-4,11,15H,5-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031932 (7-(4-Methyl-piperazin-1-yl)-6H-5-oxa-8-aza-benzo[c...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21 Show InChI InChI=1S/C21H21N3O/c1-23-10-12-24(13-11-23)21-17-14-25-19-9-5-3-7-16(19)20(17)15-6-2-4-8-18(15)22-21/h2-9H,10-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50459424 (CHEMBL64880) Show SMILES Cc1cc2nc(N3CCNCC3)n(Cc3ccccc3)c2cc1C Show InChI InChI=1S/C20H24N4/c1-15-12-18-19(13-16(15)2)24(14-17-6-4-3-5-7-17)20(22-18)23-10-8-21-9-11-23/h3-7,12-13,21H,8-11,14H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471658 (CHEMBL63091) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2CCN(C)Cc12 Show InChI InChI=1S/C18H24N4/c1-20-9-11-22(12-10-20)18-16-13-21(2)8-7-14(16)15-5-3-4-6-17(15)19-18/h3-6H,7-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471509 (CHEMBL64489) Show SMILES Clc1cc2nc(N3CCNCC3)n(Cc3ccccc3)c2cc1Cl Show InChI InChI=1S/C18H18Cl2N4/c19-14-10-16-17(11-15(14)20)24(12-13-4-2-1-3-5-13)18(22-16)23-8-6-21-7-9-23/h1-5,10-11,21H,6-9,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031925 (6-(4-Methyl-piperazin-1-yl)-7,8-dihydro-benzo[k]ph...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21 Show InChI InChI=1S/C22H23N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-9H,10-15H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031939 (6-(4-Methyl-piperazin-1-yl)-7,8-dihydro-9-oxa-5-az...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1CCOc1ccccc-21 Show InChI InChI=1S/C22H23N3O/c1-24-11-13-25(14-12-24)22-18-10-15-26-20-9-5-3-7-17(20)21(18)16-6-2-4-8-19(16)23-22/h2-9H,10-15H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471505 (CHEMBL64801) Show SMILES COc1ccc2nc(N3CCNCC3)n(Cc3ccccc3)c2c1 Show InChI InChI=1S/C19H22N4O/c1-24-16-7-8-17-18(13-16)23(14-15-5-3-2-4-6-15)19(21-17)22-11-9-20-10-12-22/h2-8,13,20H,9-12,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031928 (6-Piperazin-1-yl-7,8-dihydro-benzo[k]phenanthridin...) Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCc1ccccc-21 Show InChI InChI=1S/C21H21N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-8,22H,9-14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031923 (6-(4-Ethyl-piperazin-1-yl)-7,8-dihydro-benzo[k]phe...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21 Show InChI InChI=1S/C23H25N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-10H,2,11-16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031934 (6-(4-Methyl-piperazin-1-yl)-benzo[k]phenanthridine...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21 Show InChI InChI=1S/C22H21N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-11H,12-15H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471506 (CHEMBL60103) Show SMILES CCCn1c(nc2ccccc12)N1CCNCC1 Show InChI InChI=1S/C14H20N4/c1-2-9-18-13-6-4-3-5-12(13)16-14(18)17-10-7-15-8-11-17/h3-6,15H,2,7-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031937 (7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...) Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21 Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031938 (6-Piperazin-1-yl-7,8-dihydro-9-oxa-5-aza-benzo[6,7...) Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCOc1ccccc-21 Show InChI InChI=1S/C21H21N3O/c1-3-7-18-15(5-1)20-16-6-2-4-8-19(16)25-14-9-17(20)21(23-18)24-12-10-22-11-13-24/h1-8,22H,9-14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031936 (6-(4-Methyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]fl...) Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12 Show InChI InChI=1S/C20H19N3O/c1-22-10-12-23(13-11-22)20-19-18(14-6-2-4-8-16(14)21-20)15-7-3-5-9-17(15)24-19/h2-9H,10-13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031929 (6-(4-Ethyl-piperazin-1-yl)-7,8-dihydro-9-oxa-5-aza...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1CCOc1ccccc-21 Show InChI InChI=1S/C23H25N3O/c1-2-25-12-14-26(15-13-25)23-19-11-16-27-21-10-6-4-8-18(21)22(19)17-7-3-5-9-20(17)24-23/h3-10H,2,11-16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031940 (6-(4-Ethyl-piperazin-1-yl)-benzo[k]phenanthridine ...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21 Show InChI InChI=1S/C23H23N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-12H,2,13-16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031933 (6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...) Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12 Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50103077 (2-Piperazin-1-yl-1H-benzoimidazole | CHEMBL292066) Show SMILES C1CN(CCN1)c1nc2ccccc2[nH]1 Show InChI InChI=1S/C11H14N4/c1-2-4-10-9(3-1)13-11(14-10)15-7-5-12-6-8-15/h1-4,12H,5-8H2,(H,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031935 (8-Methoxy-6-(4-methyl-piperazin-1-yl)-benzo[k]phen...) Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCN(C)CC1 Show InChI InChI=1S/C23H23N3O/c1-25-11-13-26(14-12-25)23-19-15-21(27-2)16-7-3-4-8-17(16)22(19)18-9-5-6-10-20(18)24-23/h3-10,15H,11-14H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031924 (CHEMBL304016 | [2-(7,8-Dihydro-9-oxa-5-aza-benzo[6...) Show SMILES CN(C)CCSc1nc2ccccc2c-2c1CCOc1ccccc-21 Show InChI InChI=1S/C21H22N2OS/c1-23(2)12-14-25-21-17-11-13-24-19-10-6-4-8-16(19)20(17)15-7-3-5-9-18(15)22-21/h3-10H,11-14H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471513 (CHEMBL62270) Show SMILES Cn1c(nc2ccccc12)N1CCNCC1 Show InChI InChI=1S/C12H16N4/c1-15-11-5-3-2-4-10(11)14-12(15)16-8-6-13-7-9-16/h2-5,13H,6-9H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031921 (6-(4-Ethyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]flu...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12 Show InChI InChI=1S/C21H21N3O/c1-2-23-11-13-24(14-12-23)21-20-19(15-7-3-5-9-17(15)22-21)16-8-4-6-10-18(16)25-20/h3-10H,2,11-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031931 (7-(4-Ethyl-piperazin-1-yl)-6H-5-oxa-8-aza-benzo[c]...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21 Show InChI InChI=1S/C22H23N3O/c1-2-24-11-13-25(14-12-24)22-18-15-26-20-10-6-4-8-17(20)21(18)16-7-3-5-9-19(16)23-22/h3-10H,2,11-15H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471512 (CHEMBL62778) Show SMILES COc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCNCC1 Show InChI InChI=1S/C19H22N4O/c1-24-16-7-8-18-17(13-16)21-19(22-11-9-20-10-12-22)23(18)14-15-5-3-2-4-6-15/h2-8,13,20H,9-12,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031941 (8-Methoxy-6-piperazin-1-yl-benzo[k]phenanthridine ...) Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCNCC1 Show InChI InChI=1S/C22H21N3O/c1-26-20-14-18-21(16-7-3-2-6-15(16)20)17-8-4-5-9-19(17)24-22(18)25-12-10-23-11-13-25/h2-9,14,23H,10-13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	66	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471507 (CHEMBL64782) Show SMILES CCn1c(nc2ccccc12)N1CCNCC1 Show InChI InChI=1S/C13H18N4/c1-2-17-12-6-4-3-5-11(12)15-13(17)16-9-7-14-8-10-16/h3-6,14H,2,7-10H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	79	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031922 (6-Piperazin-1-yl-benzo[k]phenanthridine | CHEMBL61...) Show SMILES C1CN(CCN1)c1nc2ccccc2c2c1ccc1ccccc21 Show InChI InChI=1S/C21H19N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-10,22H,11-14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	132	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471502 (CHEMBL64060) Show SMILES COc1cccc2n(Cc3ccccc3)c(nc12)N1CCNCC1 Show InChI InChI=1S/C19H22N4O/c1-24-17-9-5-8-16-18(17)21-19(22-12-10-20-11-13-22)23(16)14-15-6-3-2-4-7-15/h2-9,20H,10-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031926 (6-(4-Ethyl-piperazin-1-yl)-8-methoxy-benzo[k]phena...) Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1cc(OC)c1ccccc21 Show InChI InChI=1S/C24H25N3O/c1-3-26-12-14-27(15-13-26)24-20-16-22(28-2)17-8-4-5-9-18(17)23(20)19-10-6-7-11-21(19)25-24/h4-11,16H,3,12-15H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	224	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031943 (CHEMBL64145 | Dimethyl-[2-(7-oxa-5-aza-benzo[c]flu...) Show SMILES CN(C)CCSc1nc2ccccc2c2c3ccccc3oc12 Show InChI InChI=1S/C19H18N2OS/c1-21(2)11-12-23-19-18-17(13-7-3-5-9-15(13)20-19)14-8-4-6-10-16(14)22-18/h3-10H,11-12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	407	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031927 (CHEMBL62890 | [2-(Benzo[k]phenanthridin-6-ylsulfan...) Show SMILES CN(C)CCSc1nc2ccccc2c2c1ccc1ccccc21 Show InChI InChI=1S/C21H20N2S/c1-23(2)13-14-24-21-18-12-11-15-7-3-4-8-16(15)20(18)17-9-5-6-10-19(17)22-21/h3-12H,13-14H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50471661 (CHEMBL305580) Show SMILES COc1cc2c(SCCN(C)C)nc3ccccc3c2c2ccccc12 Show InChI InChI=1S/C22H22N2OS/c1-24(2)12-13-26-22-18-14-20(25-3)15-8-4-5-9-16(15)21(18)17-10-6-7-11-19(17)23-22/h4-11,14H,12-13H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031944 (CHEMBL64079 | [2-(7,8-Dihydro-benzo[k]phenanthridi...) Show SMILES CN(C)CCSc1nc2ccccc2c-2c1CCc1ccccc-21 Show InChI InChI=1S/C21H22N2S/c1-23(2)13-14-24-21-18-12-11-15-7-3-4-8-16(15)20(18)17-9-5-6-10-19(17)22-21/h3-10H,11-14H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50031930 (CHEMBL63024 | Dimethyl-[2-(6H-5-oxa-8-aza-benzo[c]...) Show SMILES CN(C)CCSc1nc2ccccc2c-2c1COc1ccccc-21 Show InChI InChI=1S/C20H20N2OS/c1-22(2)11-12-24-20-16-13-23-18-10-6-4-8-15(18)19(16)14-7-3-5-9-17(14)21-20/h3-10H,11-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist				J Med Chem 41: 2029-39 (1998) Article DOI: 10.1021/jm970745o BindingDB Entry DOI: 10.7270/Q2CJ8H7X
					More data for this Ligand-Target Pair