BDBM50401954 CHEMBL2207636

SMILES: COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1

InChI Key: InChIKey=LQGNDHYNCHVOGU-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50401954   

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))	BDBM50401954 (CHEMBL2207636) Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1 Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D2long receptor expressed in CHO cells after 60 mins by scintillation counting analysis				Bioorg Med Chem Lett 22: 7151-4 (2012) Article DOI: 10.1016/j.bmcl.2012.09.064 BindingDB Entry DOI: 10.7270/Q2Q52QSM
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50401954 (CHEMBL2207636) Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1 Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D2short receptor expressed in CHO cells after 60 mins by scintillation counting analysis				Bioorg Med Chem Lett 22: 7151-4 (2012) Article DOI: 10.1016/j.bmcl.2012.09.064 BindingDB Entry DOI: 10.7270/Q2Q52QSM
					More data for this Ligand-Target Pair
5-HT2 (PIG)	BDBM50401954 (CHEMBL2207636) Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1 Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from 5-HT2 receptor in porcine cerebral cortex homogenate after 60 mins by scintillation counting analysis				Bioorg Med Chem Lett 22: 7151-4 (2012) Article DOI: 10.1016/j.bmcl.2012.09.064 BindingDB Entry DOI: 10.7270/Q2Q52QSM
					More data for this Ligand-Target Pair
Dopamine D1 receptor (Sus scrofa)	BDBM50401954 (CHEMBL2207636) Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1 Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Displacement of [3H]SCH23390 from dopamine D1 receptor in porcine striatal membranes after 60 mins by scintillation counting analysis				Bioorg Med Chem Lett 22: 7151-4 (2012) Article DOI: 10.1016/j.bmcl.2012.09.064 BindingDB Entry DOI: 10.7270/Q2Q52QSM
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50401954 (CHEMBL2207636) Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1 Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from human dopamine D3 receptor expressed in CHO cells after 60 mins by scintillation counting analysis				Bioorg Med Chem Lett 22: 7151-4 (2012) Article DOI: 10.1016/j.bmcl.2012.09.064 BindingDB Entry DOI: 10.7270/Q2Q52QSM
					More data for this Ligand-Target Pair