BDBM395108 US10308615, Example 119::{2-[(pyrimidin-5- ylmethyl)amino] pyrimidin-5-yl}[3- (trifluoromethyl) phenyl]methanone

SMILES: FC(F)(F)c1cccc(c1)C(=O)c1cnc(NCc2cncnc2)nc1

InChI Key: InChIKey=YXUQMWCGELHLOO-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 395108   

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
Pantetheinase (Homo sapiens (Human))	BDBM395108 (US10308615, Example 119 | {2-[(pyrimidin-5- ylmeth...) Show SMILES FC(F)(F)c1cccc(c1)C(=O)c1cnc(NCc2cncnc2)nc1 Show InChI InChI=1S/C17H12F3N5O/c18-17(19,20)14-3-1-2-12(4-14)15(26)13-8-24-16(25-9-13)23-7-11-5-21-10-22-6-11/h1-6,8-10H,7H2,(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description The vanin-1 protein was prepared in-house from a construct expressing the extracellular domain of human vanin-1 (GenBank ID NM_004666) preceded N-ter...				Bioorg Med Chem Lett 19: 3664-8 (2009) BindingDB Entry DOI: 10.7270/Q22809Z8
					More data for this Ligand-Target Pair
Pantetheinase (Homo sapiens (Human))	BDBM395108 (US10308615, Example 119 | {2-[(pyrimidin-5- ylmeth...) Show SMILES FC(F)(F)c1cccc(c1)C(=O)c1cnc(NCc2cncnc2)nc1 Show InChI InChI=1S/C17H12F3N5O/c18-17(19,20)14-3-1-2-12(4-14)15(26)13-8-24-16(25-9-13)23-7-11-5-21-10-22-6-11/h1-6,8-10H,7H2,(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11.3	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description The vanin-1 protein was prepared in-house from a construct expressing the extracellular domain of human vanin-1 (GenBank ID NM_004666) preceded N-ter...				Bioorg Med Chem Lett 19: 3664-8 (2009) BindingDB Entry DOI: 10.7270/Q22809Z8
					More data for this Ligand-Target Pair