Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with all data for entry = 4890   

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 (Mus musculus (house mouse))	BDBM82473 (CAS_124006 | GR 65630 | NSC_124006) Show SMILES Cc1nc[nH]c1CCC(=O)c1cc2ccccc2n1C Show InChI InChI=1S/C16H17N3O/c1-11-13(18-10-17-11)7-8-16(20)15-9-12-5-3-4-6-14(12)19(15)2/h3-6,9-10H,7-8H2,1-2H3,(H,17,18)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	0.210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical Research Council Centre Curated by PDSP Ki Database									J Biol Chem 270: 6056-61 (1995) Article DOI: 10.1074/jbc.270.11.6056 BindingDB Entry DOI: 10.7270/Q2NV9GR6
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Mus musculus (house mouse))	BDBM82474 (1-(3-CHLOROPHENYL)BIGUANIDE HYDROCHLORIDE | CAS_21...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6](-[#7])=[#7]-c1cccc(Cl)c1 |w:6.6| Show InChI InChI=1S/C8H10ClN5/c9-5-2-1-3-6(4-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	0.940	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical Research Council Centre Curated by PDSP Ki Database									J Biol Chem 270: 6056-61 (1995) Article DOI: 10.1074/jbc.270.11.6056 BindingDB Entry DOI: 10.7270/Q2NV9GR6
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Mus musculus (house mouse))	BDBM50241143 ((MDL 72222)3,5-Dichloro-benzoic acid 8-methyl-8-az...) Show SMILES CN1C2CCC1CC(C2)OC(=O)c1cc(Cl)cc(Cl)c1 |THB:9:7:1:3.4| Show InChI InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical Research Council Centre Curated by PDSP Ki Database									J Biol Chem 270: 6056-61 (1995) Article DOI: 10.1074/jbc.270.11.6056 BindingDB Entry DOI: 10.7270/Q2NV9GR6
					More data for this Ligand-Target Pair