BDBM127605 US8791118, 168

SMILES: C[C@H](CCCc1ccccc1)NC(=O)Nc1ccc2ncc(nc2n1)-c1cnn(CCN2CCOCC2)c1

InChI Key: InChIKey=IURZCUCAJQJUQB-OAQYLSRUSA-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 = 127605   

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 1 (Homo sapiens (Human))	BDBM127605 (US8791118, 168) Show SMILES C[C@H](CCCc1ccccc1)NC(=O)Nc1ccc2ncc(nc2n1)-c1cnn(CCN2CCOCC2)c1 |r| Show InChI InChI=1S/C28H34N8O2/c1-21(6-5-9-22-7-3-2-4-8-22)31-28(37)34-26-11-10-24-27(33-26)32-25(19-29-24)23-18-30-36(20-23)13-12-35-14-16-38-17-15-35/h2-4,7-8,10-11,18-21H,5-6,9,12-17H2,1H3,(H2,31,32,33,34,37)/t21-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.5	n/a
Aeterna Zentaris GmbH US Patent					Assay Description The inhibitory effect of the compounds according to the invention was tested on various serine/threonine, tyrosine and lipid kinases in enzymatic ass...				US Patent US8791118 (2014) BindingDB Entry DOI: 10.7270/Q2TT4PNN
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