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BDBM50287959 (E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyrazolo[3,4-b]quinolin-1-yl)-4-(4-nitro-benzenesulfonyl)-morpholin-2-yl]-1-phenyl-but-2-en-1-one::CHEMBL304474

SMILES: COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=NEIHTTLGPVTTPI-FUFSCUOVSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287959   
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
GTPase HRas


(Homo sapiens (Human))
BDBM50287959
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |w:24.28|
Show InChI InChI=1S/C32H28ClN5O7S/c1-20-30-31(33)26-17-23(44-2)13-16-27(26)34-32(30)37(35-20)29-19-36(46(42,43)25-14-11-22(12-15-25)38(40)41)18-24(45-29)9-6-10-28(39)21-7-4-3-5-8-21/h3-9,11-17,24,29H,10,18-19H2,1-2H3/t24-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 7.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)


Article DOI: 10.1016/0960-894X(95)00574-D
BindingDB Entry DOI: 10.7270/Q2G160TB
More data for this
Ligand-Target Pair