BDBM113798 6-((4-Chloro-2-fluorophenyl)(cyano)methyl) picolinonitrile (30)

SMILES: Fc1cc(Cl)ccc1C(C#N)c1cccc(n1)C#N

InChI Key: InChIKey=YAMKBEINJXJHEA-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 = 113798   

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
PvdQ (Pseudomonas aeruginosa)	BDBM113798 (6-((4-Chloro-2-fluorophenyl)(cyano)methyl) picolin...) Show SMILES Fc1cc(Cl)ccc1C(C#N)c1cccc(n1)C#N Show InChI InChI=1S/C14H7ClFN3/c15-9-4-5-11(13(16)6-9)12(8-18)14-3-1-2-10(7-17)19-14/h1-6,12H	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
The Broad Institute , Cambridge, Massachusetts 02142, United States					Assay Description The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro...				ACS Chem Biol 9: 1536-44 (2014) Article DOI: 10.1021/cb5001586 BindingDB Entry DOI: 10.7270/Q2PC311M
					More data for this Ligand-Target Pair