BDBM50290210 CHEMBL78368::Thiophene-2-carboxylic acid (4-{2-[4-(3-chloro-phenyl)-piperazin-1-yl]-ethyl}-cyclohexyl)-amide

SMILES: Clc1cccc(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2cccs2)CC1

InChI Key: InChIKey=MBJIMEPOUWVXCI-KESTWPANSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50290210   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50290210 (CHEMBL78368 | Thiophene-2-carboxylic acid (4-{2-[4...) Show SMILES Clc1cccc(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2cccs2)CC1 |wU:13.13,wD:16.20,(18.02,-2.32,;17.27,-3.67,;18.09,-5,;17.34,-6.35,;15.8,-6.38,;15.01,-5.06,;15.75,-3.72,;13.47,-5.09,;12.74,-6.42,;11.2,-6.46,;10.39,-5.16,;8.85,-5.19,;8.1,-6.52,;6.56,-6.53,;5.77,-7.86,;4.23,-7.87,;3.48,-6.54,;4.23,-5.21,;5.77,-5.2,;1.94,-6.54,;1.17,-7.87,;-.37,-7.89,;1.94,-9.2,;3.46,-9.29,;3.32,-11.95,;1.78,-11.86,;1.08,-10.5,;11.14,-3.81,;12.68,-3.78,)| Show InChI InChI=1S/C23H30ClN3OS/c24-19-3-1-4-21(17-19)27-14-12-26(13-15-27)11-10-18-6-8-20(9-7-18)25-23(28)22-5-2-16-29-22/h1-5,16-18,20H,6-15H2,(H,25,28)/t18-,20-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to displace radioligand [3H]spiperone from human dopamine D3 receptor transfected chinese hamster ovary cell membranes.				Bioorg Med Chem Lett 7: 2403-2408 (1997) Article DOI: 10.1016/S0960-894X(97)00443-5 BindingDB Entry DOI: 10.7270/Q27W6CQ0
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50290210 (CHEMBL78368 | Thiophene-2-carboxylic acid (4-{2-[4...) Show SMILES Clc1cccc(c1)N1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2cccs2)CC1 |wU:13.13,wD:16.20,(18.02,-2.32,;17.27,-3.67,;18.09,-5,;17.34,-6.35,;15.8,-6.38,;15.01,-5.06,;15.75,-3.72,;13.47,-5.09,;12.74,-6.42,;11.2,-6.46,;10.39,-5.16,;8.85,-5.19,;8.1,-6.52,;6.56,-6.53,;5.77,-7.86,;4.23,-7.87,;3.48,-6.54,;4.23,-5.21,;5.77,-5.2,;1.94,-6.54,;1.17,-7.87,;-.37,-7.89,;1.94,-9.2,;3.46,-9.29,;3.32,-11.95,;1.78,-11.86,;1.08,-10.5,;11.14,-3.81,;12.68,-3.78,)| Show InChI InChI=1S/C23H30ClN3OS/c24-19-3-1-4-21(17-19)27-14-12-26(13-15-27)11-10-18-6-8-20(9-7-18)25-23(28)22-5-2-16-29-22/h1-5,16-18,20H,6-15H2,(H,25,28)/t18-,20-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to displace radioligand [3H]N-0437 from human dopamine D2 receptor transfected chinese hamster ovary cell membranes.				Bioorg Med Chem Lett 7: 2403-2408 (1997) Article DOI: 10.1016/S0960-894X(97)00443-5 BindingDB Entry DOI: 10.7270/Q27W6CQ0
					More data for this Ligand-Target Pair