BDBM50190211 3-ethoxy-benzo[b]thiophene-2-carboxylic acid [8-chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-amide::CHEMBL378914

SMILES: CCOc1c(sc2ccccc12)C(=O)NN1c2ccc(Cl)cc2N=C(N2CCN(C)CC2)c2ccccc12

InChI Key: InChIKey=XUTRVIHVFHKDOS-UHFFFAOYSA-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 = 50190211   

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(1A) dopamine receptor (Homo sapiens (Human))	BDBM50190211 (3-ethoxy-benzo[b]thiophene-2-carboxylic acid [8-ch...) Show SMILES CCOc1c(sc2ccccc12)C(=O)NN1c2ccc(Cl)cc2N=C(N2CCN(C)CC2)c2ccccc12 |t:26| Show InChI InChI=1S/C29H28ClN5O2S/c1-3-37-26-21-9-5-7-11-25(21)38-27(26)29(36)32-35-23-10-6-4-8-20(23)28(34-16-14-33(2)15-17-34)31-22-18-19(30)12-13-24(22)35/h4-13,18H,3,14-17H2,1-2H3,(H,32,36)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]SCH 23390 from human dopamine D1 receptor expressed in CHO cells				Bioorg Med Chem Lett 16: 4543-7 (2006) Article DOI: 10.1016/j.bmcl.2006.06.022 BindingDB Entry DOI: 10.7270/Q2GT5MSW
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50190211 (3-ethoxy-benzo[b]thiophene-2-carboxylic acid [8-ch...) Show SMILES CCOc1c(sc2ccccc12)C(=O)NN1c2ccc(Cl)cc2N=C(N2CCN(C)CC2)c2ccccc12 |t:26| Show InChI InChI=1S/C29H28ClN5O2S/c1-3-37-26-21-9-5-7-11-25(21)38-27(26)29(36)32-35-23-10-6-4-8-20(23)28(34-16-14-33(2)15-17-34)31-22-18-19(30)12-13-24(22)35/h4-13,18H,3,14-17H2,1-2H3,(H,32,36)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	196	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]methylspiperone from human dopamine D2 receptor expressed in CHO cells				Bioorg Med Chem Lett 16: 4543-7 (2006) Article DOI: 10.1016/j.bmcl.2006.06.022 BindingDB Entry DOI: 10.7270/Q2GT5MSW
					More data for this Ligand-Target Pair