BDBM163017 US9056865, A-144

SMILES: Cc1cc(F)cnc1-c1cc(ncc1Cl)N1CCC(CC1)NC(=O)CCS(C)(=O)=O

InChI Key: InChIKey=ZVBZRDUDKIIWNT-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 163017   

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
G-protein- coupled-like receptor Smoothened (Smo) (Homo sapiens (Human))	BDBM163017 (US9056865, A-144) Show SMILES Cc1cc(F)cnc1-c1cc(ncc1Cl)N1CCC(CC1)NC(=O)CCS(C)(=O)=O Show InChI InChI=1S/C20H24ClFN4O3S/c1-13-9-14(22)11-24-20(13)16-10-18(23-12-17(16)21)26-6-3-15(4-7-26)25-19(27)5-8-30(2,28)29/h9-12,15H,3-8H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	29.8	n/a	n/a	n/a	n/a	n/a	25
Pfizer Inc. US Patent					Assay Description For the binding competition assay, 100 μL of Assay Buffer was added to all the wells of a 96 well GF/B filter plate (Millipore MultiScreen-HTS-F...				US Patent US9056865 (2015) BindingDB Entry DOI: 10.7270/Q2R49PH7
					More data for this Ligand-Target Pair