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BDBM50287953 5-(4-chloro-6-methoxy-3-methyl-1H-pyrazolo[3,4-b]quinolin-1-yl)-3,4-di(2-furylcarbonyloxy)-2-(2-furylcarbonyloxymethyl)-(2R,3R,4R,5R)-tetrahydrofuran::CHEMBL304883

SMILES: COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccco2)[C@@H](OC(=O)c2ccco2)[C@H]1OC(=O)c1ccco1

InChI Key: InChIKey=RFXHLDFRFCKXCR-FLKHEUMLSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287953   
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))
BDBM50287953
PNG
(5-(4-chloro-6-methoxy-3-methyl-1H-pyrazolo[3,4-b]q...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccco2)[C@@H](OC(=O)c2ccco2)[C@H]1OC(=O)c1ccco1
Show InChI InChI=1S/C32H24ClN3O11/c1-16-24-25(33)18-14-17(40-2)9-10-19(18)34-28(24)36(35-16)29-27(47-32(39)22-8-5-13-43-22)26(46-31(38)21-7-4-12-42-21)23(45-29)15-44-30(37)20-6-3-11-41-20/h3-14,23,26-27,29H,15H2,1-2H3/t23-,26-,27-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 1.05E+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