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BDBM50105615 5-tert-Butyl-3-[3-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-ureido]-thiophene-2-carboxylic acid methyl ester::CHEMBL316315

SMILES: COC(=O)c1sc(cc1NC(=O)Nc1nnc(s1)C(F)(F)F)C(C)(C)C

InChI Key: InChIKey=VOTWXOALGLSUAW-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50105615   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50105615
PNG
(5-tert-Butyl-3-[3-(5-trifluoromethyl-[1,3,4]thiadi...)
Show SMILES COC(=O)c1sc(cc1NC(=O)Nc1nnc(s1)C(F)(F)F)C(C)(C)C
Show InChI InChI=1S/C14H15F3N4O3S2/c1-13(2,3)7-5-6(8(25-7)9(22)24-4)18-11(23)19-12-21-20-10(26-12)14(15,16)17/h5H,1-4H3,(H2,18,19,21,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 6.60E+3n/an/an/an/an/an/a



Bayer Research Center

Curated by ChEMBL


Assay Description
Inhibitory concentration against raf kinase.


Bioorg Med Chem Lett 11: 2775-8 (2001)


BindingDB Entry DOI: 10.7270/Q2NS0VD5
More data for this
Ligand-Target Pair