BDBM50306451 (6aS,13bS)-11-chloro-7-methyl-4-(thiophen-2-yl)-6,6a,7,8,9,13b-hexahydro-5H-benzo[d]naphtho[2,1-b]azepin-12-ol::CHEMBL597900

SMILES: CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1c2cccc1-c1cccs1

InChI Key: InChIKey=PRPIHWHFWBQGCY-NZQKXSOJSA-N

Data: 4 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 4 hits for monomerid = 50306451   

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))	BDBM50306451 ((6aS,13bS)-11-chloro-7-methyl-4-(thiophen-2-yl)-6,...) Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1c2cccc1-c1cccs1 |r| Show InChI InChI=1S/C23H22ClNOS/c1-25-10-9-14-12-19(24)21(26)13-18(14)23-17-5-2-4-16(22-6-3-11-27-22)15(17)7-8-20(23)25/h2-6,11-13,20,23,26H,7-10H2,1H3/t20-,23+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]SCh23390 from dopamine D1 receptor expressed in mouse LTK cells by scintillation counting				Bioorg Med Chem Lett 20: 832-5 (2010) Article DOI: 10.1016/j.bmcl.2009.12.094 BindingDB Entry DOI: 10.7270/Q2FX79JH
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50306451 ((6aS,13bS)-11-chloro-7-methyl-4-(thiophen-2-yl)-6,...) Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1c2cccc1-c1cccs1 |r| Show InChI InChI=1S/C23H22ClNOS/c1-25-10-9-14-12-19(24)21(26)13-18(14)23-17-5-2-4-16(22-6-3-11-27-22)15(17)7-8-20(23)25/h2-6,11-13,20,23,26H,7-10H2,1H3/t20-,23+/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of radioligand from dopamine D5 receptor expressed in mouse LTK cells by scintillation counting				Bioorg Med Chem Lett 20: 832-5 (2010) Article DOI: 10.1016/j.bmcl.2009.12.094 BindingDB Entry DOI: 10.7270/Q2FX79JH
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50306451 ((6aS,13bS)-11-chloro-7-methyl-4-(thiophen-2-yl)-6,...) Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1c2cccc1-c1cccs1 |r| Show InChI InChI=1S/C23H22ClNOS/c1-25-10-9-14-12-19(24)21(26)13-18(14)23-17-5-2-4-16(22-6-3-11-27-22)15(17)7-8-20(23)25/h2-6,11-13,20,23,26H,7-10H2,1H3/t20-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]methylspiperon from dopamine D2 receptor expressed in mouse LTK cells by scintillation counting				Bioorg Med Chem Lett 20: 832-5 (2010) Article DOI: 10.1016/j.bmcl.2009.12.094 BindingDB Entry DOI: 10.7270/Q2FX79JH
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50306451 ((6aS,13bS)-11-chloro-7-methyl-4-(thiophen-2-yl)-6,...) Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1c2cccc1-c1cccs1 |r| Show InChI InChI=1S/C23H22ClNOS/c1-25-10-9-14-12-19(24)21(26)13-18(14)23-17-5-2-4-16(22-6-3-11-27-22)15(17)7-8-20(23)25/h2-6,11-13,20,23,26H,7-10H2,1H3/t20-,23+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of radioligand from dopamine D4 receptor expressed in mouse LTK cells by scintillation counting				Bioorg Med Chem Lett 20: 832-5 (2010) Article DOI: 10.1016/j.bmcl.2009.12.094 BindingDB Entry DOI: 10.7270/Q2FX79JH
					More data for this Ligand-Target Pair