BDBM50219202 CHEMBL161126

SMILES: Fc1ccc(\C=C\C(=O)N[C@H]2CC[C@H](CCN3Cc4ccc(cc4C3)C(F)(F)F)CC2)cc1

InChI Key: InChIKey=KUBCXXBTKZCFPE-PKWGFICBSA-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 = 50219202   

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 (Homo sapiens (Human))	BDBM50219202 (CHEMBL161126) Show SMILES Fc1ccc(\C=C\C(=O)N[C@H]2CC[C@H](CCN3Cc4ccc(cc4C3)C(F)(F)F)CC2)cc1 |wU:10.9,wD:13.13,(23.76,-7.72,;22.66,-8.82,;22.66,-10.37,;21.32,-11.14,;19.99,-10.37,;18.66,-11.11,;17.33,-10.34,;15.98,-11.11,;15.99,-12.66,;14.64,-10.37,;13.3,-11.11,;13.3,-12.66,;11.97,-13.43,;10.64,-12.66,;9.15,-13.08,;7.82,-12.31,;6.48,-13.08,;5.56,-11.84,;4.09,-12.33,;2.76,-11.56,;1.43,-12.33,;1.43,-13.87,;2.77,-14.64,;4.1,-13.87,;5.59,-14.34,;.09,-14.64,;-.19,-16.23,;-1.14,-15.32,;-1.42,-14.06,;10.64,-11.11,;11.97,-10.34,;19.98,-8.82,;21.31,-8.05,)| Show InChI InChI=1S/C26H28F4N2O/c27-23-8-1-18(2-9-23)5-12-25(33)31-24-10-3-19(4-11-24)13-14-32-16-20-6-7-22(26(28,29)30)15-21(20)17-32/h1-2,5-9,12,15,19,24H,3-4,10-11,13-14,16-17H2,(H,31,33)/b12-5+/t19-,24-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 11: 685-8 (2001) BindingDB Entry DOI: 10.7270/Q2JS9SMH
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50219202 (CHEMBL161126) Show SMILES Fc1ccc(\C=C\C(=O)N[C@H]2CC[C@H](CCN3Cc4ccc(cc4C3)C(F)(F)F)CC2)cc1 |wU:10.9,wD:13.13,(23.76,-7.72,;22.66,-8.82,;22.66,-10.37,;21.32,-11.14,;19.99,-10.37,;18.66,-11.11,;17.33,-10.34,;15.98,-11.11,;15.99,-12.66,;14.64,-10.37,;13.3,-11.11,;13.3,-12.66,;11.97,-13.43,;10.64,-12.66,;9.15,-13.08,;7.82,-12.31,;6.48,-13.08,;5.56,-11.84,;4.09,-12.33,;2.76,-11.56,;1.43,-12.33,;1.43,-13.87,;2.77,-14.64,;4.1,-13.87,;5.59,-14.34,;.09,-14.64,;-.19,-16.23,;-1.14,-15.32,;-1.42,-14.06,;10.64,-11.11,;11.97,-10.34,;19.98,-8.82,;21.31,-8.05,)| Show InChI InChI=1S/C26H28F4N2O/c27-23-8-1-18(2-9-23)5-12-25(33)31-24-10-3-19(4-11-24)13-14-32-16-20-6-7-22(26(28,29)30)15-21(20)17-32/h1-2,5-9,12,15,19,24H,3-4,10-11,13-14,16-17H2,(H,31,33)/b12-5+/t19-,24-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D2 expressed in CHO cells				Bioorg Med Chem Lett 11: 685-8 (2001) BindingDB Entry DOI: 10.7270/Q2JS9SMH
					More data for this Ligand-Target Pair