BDBM50505894 CHEMBL4452908

SMILES: CC(C)CCCNC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1

InChI Key: InChIKey=FNEBPJGKFXFLMU-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 = 50505894   

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
p38 MAP kinase alpha/beta (Homo sapiens (Human))	BDBM50505894 (CHEMBL4452908) Show SMILES CC(C)CCCNC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 Show InChI InChI=1S/C24H29N5O2/c1-17(2)7-6-14-26-23(30)19-12-10-18(11-13-19)15-27-24(31)21-16-28-29(22(21)25)20-8-4-3-5-9-20/h3-5,8-13,16-17H,6-7,14-15,25H2,1-2H3,(H,26,30)(H,27,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	730	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-University Curated by ChEMBL					Assay Description Inhibition of recombinant human His-tagged P38beta MAPK (1 to 364 residues) expressed in Escherichia coli incubated for 60 mins by [gamma-33P]ATP bas...				J Med Chem 62: 10757-10782 (2019) Article DOI: 10.1021/acs.jmedchem.9b01227
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50505894 (CHEMBL4452908) Show SMILES CC(C)CCCNC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 Show InChI InChI=1S/C24H29N5O2/c1-17(2)7-6-14-26-23(30)19-12-10-18(11-13-19)15-27-24(31)21-16-28-29(22(21)25)20-8-4-3-5-9-20/h3-5,8-13,16-17H,6-7,14-15,25H2,1-2H3,(H,26,30)(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-University Curated by ChEMBL					Assay Description Inhibition of recombinant human His-tagged P38 alpha MAPK (1 to 360 residues) expressed in Escherichia coli incubated for 60 mins by [gamma-33P]ATP b...				J Med Chem 62: 10757-10782 (2019) Article DOI: 10.1021/acs.jmedchem.9b01227
					More data for this Ligand-Target Pair