BDBM50425349 CHEMBL2316492

SMILES: CC1(C)OC[C@H](COc2ccc3CCc4cc(Nc5ccc(F)c(NC(=O)c6cccs6)c5)ccc4C(=O)c3c2)O1

InChI Key: InChIKey=UITMZKXRMLVMLV-DEOSSOPVSA-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 = 50425349   

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))	BDBM50425349 (CHEMBL2316492) Show SMILES CC1(C)OC[C@H](COc2ccc3CCc4cc(Nc5ccc(F)c(NC(=O)c6cccs6)c5)ccc4C(=O)c3c2)O1 |r| Show InChI InChI=1S/C32H29FN2O5S/c1-32(2)39-18-24(40-32)17-38-23-10-7-19-5-6-20-14-21(8-11-25(20)30(36)26(19)16-23)34-22-9-12-27(33)28(15-22)35-31(37)29-4-3-13-41-29/h3-4,7-16,24,34H,5-6,17-18H2,1-2H3,(H,35,37)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
University of T£bingen Curated by ChEMBL					Assay Description Inhibition of p38alpha MAP kinase in whole blood (unknown origin) assessed as lipopolysaccharide-stimulated TNF-alpha release by ELISA				J Med Chem 56: 241-53 (2013) Article DOI: 10.1021/jm301539x BindingDB Entry DOI: 10.7270/Q2TB187B
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50425349 (CHEMBL2316492) Show SMILES CC1(C)OC[C@H](COc2ccc3CCc4cc(Nc5ccc(F)c(NC(=O)c6cccs6)c5)ccc4C(=O)c3c2)O1 |r| Show InChI InChI=1S/C32H29FN2O5S/c1-32(2)39-18-24(40-32)17-38-23-10-7-19-5-6-20-14-21(8-11-25(20)30(36)26(19)16-23)34-22-9-12-27(33)28(15-22)35-31(37)29-4-3-13-41-29/h3-4,7-16,24,34H,5-6,17-18H2,1-2H3,(H,35,37)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
University of T£bingen Curated by ChEMBL					Assay Description Inhibition of p38alpha MAP kinase (unknown origin) by ELISA				J Med Chem 56: 241-53 (2013) Article DOI: 10.1021/jm301539x BindingDB Entry DOI: 10.7270/Q2TB187B
					More data for this Ligand-Target Pair