BDBM50184431 3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine::CHEMBL203047

SMILES: CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1

InChI Key: InChIKey=NVVFACNDFFNYNI-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50184431   

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(2) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from D2L dopamine receptor				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D5 dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Displacement of [3H]SCH 23390 from D1 dopamine receptor				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D2L dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Binding affinity to D5 dopamine receptor by radioligand binding assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Inhibition of D1 dopamine receptor in HEK 293 cells by intracellular calcium assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50184431 (3-Chloro-2-hydroxy-7-methyl-5,6,7,8,9,14-hexahydro...) Show SMILES CN1CCc2ccccc2Cc2cc(O)c(Cl)cc2CC1 Show InChI InChI=1S/C18H20ClNO/c1-20-8-6-13-4-2-3-5-14(13)10-16-12-18(21)17(19)11-15(16)7-9-20/h2-5,11-12,21H,6-10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Schiller-Universität Jena Curated by ChEMBL					Assay Description Binding affinity to D3 dopamine receptor by radioligand binding assay				J Med Chem 49: 2110-6 (2006) Article DOI: 10.1021/jm051237e BindingDB Entry DOI: 10.7270/Q2ZW1KHD
					More data for this Ligand-Target Pair