BDBM50156935 CHEMBL3792805

SMILES: COc1ccc2c(CN3CCO[C@H](COc4ccccc4)C3)c[nH]c2c1

InChI Key: InChIKey=UKYQZIPQRMDPSD-TWYLJJHKNA-N

Data: 1 KI  1 IC50

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 = 50156935   

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
Dopamine receptors; D2 & D4 (Homo sapiens (Human))	BDBM50156935 (CHEMBL3792805) Show SMILES COc1ccc2c(CN3CCO[C@H](COc4ccccc4)C3)c[nH]c2c1 |r| Show InChI InChI=1/C21H24N2O3/c1-24-18-7-8-20-16(12-22-21(20)11-18)13-23-9-10-25-19(14-23)15-26-17-5-3-2-4-6-17/h2-8,11-12,19,22H,9-10,13-15H2,1H3/t19-/s2	Reactome pathway KEGG DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Displacement of [3H]-Spiperone from human recombinant dopamine D4 receptor expressed in CHOK1 cells				Bioorg Med Chem Lett 26: 2481-8 (2016) BindingDB Entry DOI: 10.7270/Q2G44S5M
					More data for this Ligand-Target Pair
Dopamine receptors; D2 & D4 (Homo sapiens (Human))	BDBM50156935 (CHEMBL3792805) Show SMILES COc1ccc2c(CN3CCO[C@H](COc4ccccc4)C3)c[nH]c2c1 |r| Show InChI InChI=1/C21H24N2O3/c1-24-18-7-8-20-16(12-22-21(20)11-18)13-23-9-10-25-19(14-23)15-26-17-5-3-2-4-6-17/h2-8,11-12,19,22H,9-10,13-15H2,1H3/t19-/s2	Reactome pathway KEGG DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Displacement of [3H]-Spiperone from human recombinant dopamine D4 receptor expressed in CHOK1 cells				Bioorg Med Chem Lett 26: 2481-8 (2016) BindingDB Entry DOI: 10.7270/Q2G44S5M
					More data for this Ligand-Target Pair