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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein Wnt-3a' and Ligand = 'BDBM346239'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein Wnt-3a


(Mus musculus)
BDBM346239
PNG
(2-[5-fluoro-4-(2-methyl-4-pyridyl)pyrrolo[2,3-b]py...)
Show SMILES Cc1cc(ccn1)-c1c(F)cnc2n(CC(=O)Nc3ccc(cn3)-c3cnccn3)ccc12
Show InChI InChI=1S/C24H18FN7O/c1-15-10-16(4-6-27-15)23-18-5-9-32(24(18)30-12-19(23)25)14-22(33)31-21-3-2-17(11-29-21)20-13-26-7-8-28-20/h2-13H,14H2,1H3,(H,29,31,33)
PDB

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UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1n/an/an/an/an/an/a



Redx Pharma PLC

US Patent


Assay Description
Mouse L cells transfected to constitutively produce biologically active murine Wnt-3a, referred to as L-Wnt cells, were purchased from the American T...


US Patent US10202375 (2019)


BindingDB Entry DOI: 10.7270/Q29W0HMN
More data for this
Ligand-Target Pair
Protein Wnt-3a


(Mus musculus)
BDBM346239
PNG
(2-[5-fluoro-4-(2-methyl-4-pyridyl)pyrrolo[2,3-b]py...)
Show SMILES Cc1cc(ccn1)-c1c(F)cnc2n(CC(=O)Nc3ccc(cn3)-c3cnccn3)ccc12
Show InChI InChI=1S/C24H18FN7O/c1-15-10-16(4-6-27-15)23-18-5-9-32(24(18)30-12-19(23)25)14-22(33)31-21-3-2-17(11-29-21)20-13-26-7-8-28-20/h2-13H,14H2,1H3,(H,29,31,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1n/an/an/an/an/an/a



Redx Pharma PLC

US Patent


Assay Description
Mouse L cells transfected to constitutively produce biologically active murine Wnt-3a, referred to as L-Wnt cells, were purchased from the American T...


US Patent US10202375 (2019)


BindingDB Entry DOI: 10.7270/Q29W0HMN
More data for this
Ligand-Target Pair