BDBM50533797 CHEMBL4535068

SMILES: CCCN(CCCc1ccc(O)c(O)c1)C1CCc2nc(N)sc2C1

InChI Key: InChIKey=YBQDTFTUENERQZ-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 = 50533797   

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(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50533797 (CHEMBL4535068) Show SMILES CCCN(CCCc1ccc(O)c(O)c1)C1CCc2nc(N)sc2C1 Show InChI InChI=1S/C19H27N3O2S/c1-2-9-22(10-3-4-13-5-8-16(23)17(24)11-13)14-6-7-15-18(12-14)25-19(20)21-15/h5,8,11,14,23-24H,2-4,6-7,9-10,12H2,1H3,(H2,20,21)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from rat D3 dopamine receptor expressed in HEK293 cell membranes after 1 hr				Bioorg Med Chem 24: 5088-5102 (2016) Article DOI: 10.1016/j.bmc.2016.08.021
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50533797 (CHEMBL4535068) Show SMILES CCCN(CCCc1ccc(O)c(O)c1)C1CCc2nc(N)sc2C1 Show InChI InChI=1S/C19H27N3O2S/c1-2-9-22(10-3-4-13-5-8-16(23)17(24)11-13)14-6-7-15-18(12-14)25-19(20)21-15/h5,8,11,14,23-24H,2-4,6-7,9-10,12H2,1H3,(H2,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	499	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from rat D2L dopamine receptor expressed in HEK293 cell membranes after 1 hr				Bioorg Med Chem 24: 5088-5102 (2016) Article DOI: 10.1016/j.bmc.2016.08.021
					More data for this Ligand-Target Pair