BDBM50505873 CHEMBL4455632

SMILES: CC(C)CC[C@H](NC(=O)c1cnc(CNC(=O)c2cnn(c2N)-c2ccccc2)s1)C(N)=O

InChI Key: InChIKey=CZAWAFOUKZUPDT-INIZCTEOSA-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 = 50505873   

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))	BDBM50505873 (CHEMBL4455632) Show SMILES CC(C)CC[C@H](NC(=O)c1cnc(CNC(=O)c2cnn(c2N)-c2ccccc2)s1)C(N)=O |r| Show InChI InChI=1S/C22H27N7O3S/c1-13(2)8-9-16(20(24)30)28-22(32)17-11-25-18(33-17)12-26-21(31)15-10-27-29(19(15)23)14-6-4-3-5-7-14/h3-7,10-11,13,16H,8-9,12,23H2,1-2H3,(H2,24,30)(H,26,31)(H,28,32)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+3	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))	BDBM50505873 (CHEMBL4455632) Show SMILES CC(C)CC[C@H](NC(=O)c1cnc(CNC(=O)c2cnn(c2N)-c2ccccc2)s1)C(N)=O |r| Show InChI InChI=1S/C22H27N7O3S/c1-13(2)8-9-16(20(24)30)28-22(32)17-11-25-18(33-17)12-26-21(31)15-10-27-29(19(15)23)14-6-4-3-5-7-14/h3-7,10-11,13,16H,8-9,12,23H2,1-2H3,(H2,24,30)(H,26,31)(H,28,32)/t16-/m0/s1	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	120	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