BDBM1889 3-(4-cyano-1,3-thiazol-2-yl)-1-[2-(2,6-difluorophenyl)ethyl]thiourea::N-(2-(2,6-Difluorophenyl)ethyl)-N -(2-(4-cyanothiazolyl))thiourea::PETT Analog 56

SMILES: Fc1cccc(F)c1CCNC(=S)Nc1nc(cs1)C#N

InChI Key: InChIKey=GDGAUOBZPMXAIE-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 = 1889   

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
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1)	BDBM1889 (3-(4-cyano-1,3-thiazol-2-yl)-1-[2-(2,6-difluorophe...) Show SMILES Fc1cccc(F)c1CCNC(=S)Nc1nc(cs1)C#N Show InChI InChI=1S/C13H10F2N4S2/c14-10-2-1-3-11(15)9(10)4-5-17-12(20)19-13-18-8(6-16)7-21-13/h1-3,7H,4-5H2,(H2,17,18,19,20)	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	7.8	37
Lilly Research Laboratories					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 38: 4929-36 (1995) Article DOI: 10.1021/jm00025a010 BindingDB Entry DOI: 10.7270/Q2639MXG
					More data for this Ligand-Target Pair