BDBM50496090 CHEMBL3120968

SMILES: Cn1c(nc(c1-c1ccncc1)-c1ccc(F)cc1)-c1cn(nn1)C(C)(C)C(O)=O

InChI Key: InChIKey=QTKZQUUSBRYCAQ-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 = 50496090   

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
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50496090 (CHEMBL3120968) Show SMILES Cn1c(nc(c1-c1ccncc1)-c1ccc(F)cc1)-c1cn(nn1)C(C)(C)C(O)=O Show InChI InChI=1S/C21H19FN6O2/c1-21(2,20(29)30)28-12-16(25-26-28)19-24-17(13-4-6-15(22)7-5-13)18(27(19)3)14-8-10-23-11-9-14/h4-12H,1-3H3,(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syncom B.V. Curated by ChEMBL					Assay Description Inhibition of p38a MAPK (unknown origin) by radiometric assay				Bioorg Med Chem Lett 24: 1352-7 (2014) Article DOI: 10.1016/j.bmcl.2014.01.034 BindingDB Entry DOI: 10.7270/Q2D221KT
					More data for this Ligand-Target Pair