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BDBM50287947 (E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyrazolo[3,4-b]quinolin-1-yl)-4-(2-nitro-phenylsulfanyl)-morpholin-2-yl]-but-2-enoic acid ethyl ester::CHEMBL299877

SMILES: CCOC(=O)\C=C\C[C@@H]1CN(C[C@@H](O1)n1nc(C)c2c(Cl)c3cc(OC)ccc3nc12)Sc1ccccc1[N+]([O-])=O

InChI Key: InChIKey=UPDISUVQPKSYEW-SOBDKCRDSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287947   
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))
BDBM50287947
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES CCOC(=O)\C=C\C[C@@H]1CN(C[C@@H](O1)n1nc(C)c2c(Cl)c3cc(OC)ccc3nc12)Sc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C28H28ClN5O6S/c1-4-39-25(35)11-7-8-19-15-32(41-23-10-6-5-9-22(23)34(36)37)16-24(40-19)33-28-26(17(2)31-33)27(29)20-14-18(38-3)12-13-21(20)30-28/h5-7,9-14,19,24H,4,8,15-16H2,1-3H3/b11-7+/t19-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 1.60E+4n/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