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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase receptor Ret' and Ligand = 'BDBM473666'   
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
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM473666
PNG
(1-tert-Butyl-3-{1H-pyrrolo[2,3-b]pyridin-2- yl}-1H...)
Show SMILES CC(C)(C)n1nc(-c2cc3cccnc3[nH]2)c2c(N)ncnc12
Show InChI InChI=1S/C16H17N7/c1-16(2,3)23-15-11(13(17)19-8-20-15)12(22-23)10-7-9-5-4-6-18-14(9)21-10/h4-8H,1-3H3,(H,18,21)(H2,17,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 0.700n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q28S4TVP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM473666
PNG
(1-tert-Butyl-3-{1H-pyrrolo[2,3-b]pyridin-2- yl}-1H...)
Show SMILES CC(C)(C)n1nc(-c2cc3cccnc3[nH]2)c2c(N)ncnc12
Show InChI InChI=1S/C16H17N7/c1-16(2,3)23-15-11(13(17)19-8-20-15)12(22-23)10-7-9-5-4-6-18-14(9)21-10/h4-8H,1-3H3,(H,18,21)(H2,17,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.700n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
RET and KDR: Kinase activity was detected using CisBio HTRF kinEASE kit based on time-resolved fluorescence transfer (FRET). The assay was performed ...


US Patent US10844067 (2020)


BindingDB Entry DOI: 10.7270/Q2HQ4308
More data for this
Ligand-Target Pair