BDBM50505916 CHEMBL4440391

SMILES: CC(NC(=O)c1cnn(c1)-c1ccccc1C)c1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O

InChI Key: InChIKey=DEKFGWQHJRCSSP-UQTORGHUSA-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 = 50505916   

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))	BDBM50505916 (CHEMBL4440391) Show SMILES CC(NC(=O)c1cnn(c1)-c1ccccc1C)c1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O |r| Show InChI InChI=1S/C30H37N5O3/c1-20-8-6-7-11-27(20)35-19-25(18-32-35)30(38)33-21(2)23-13-15-24(16-14-23)29(37)34-26(28(31)36)17-12-22-9-4-3-5-10-22/h6-8,11,13-16,18-19,21-22,26H,3-5,9-10,12,17H2,1-2H3,(H2,31,36)(H,33,38)(H,34,37)/t21?,26-/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	91	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
p38 MAP kinase alpha/beta (Homo sapiens (Human))	BDBM50505916 (CHEMBL4440391) Show SMILES CC(NC(=O)c1cnn(c1)-c1ccccc1C)c1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O |r| Show InChI InChI=1S/C30H37N5O3/c1-20-8-6-7-11-27(20)35-19-25(18-32-35)30(38)33-21(2)23-13-15-24(16-14-23)29(37)34-26(28(31)36)17-12-22-9-4-3-5-10-22/h6-8,11,13-16,18-19,21-22,26H,3-5,9-10,12,17H2,1-2H3,(H2,31,36)(H,33,38)(H,34,37)/t21?,26-/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	970	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