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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'SH2B adapter protein 2' and Ligand = 'BDBM479348'   
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
SH2B adapter protein 2


(Human)
BDBM479348
PNG
((3-((S)-5-amino-5,7-dihydrospiro[cyclo- penta[b]py...)
Show SMILES COC[C@@H]1C[C@H]2COc3c(Sc4cnc(N5CCC6(Cc7ncccc7[C@H]6N)CC5)c(CO)n4)ccnc3N2C1 |r|
Show InChI InChI=1S/C29H35N7O3S/c1-38-16-18-11-19-17-39-25-23(4-8-32-28(25)36(19)14-18)40-24-13-33-27(22(15-37)34-24)35-9-5-29(6-10-35)12-21-20(26(29)30)3-2-7-31-21/h2-4,7-8,13,18-19,26,37H,5-6,9-12,14-17,30H2,1H3/t18-,19+,26-/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.20n/an/an/an/an/an/a


TBA

Assay Description
The phosphatase reactions were carried out at room temperature in 384-well black polystyrene plates (Greiner Bio-One, Cat #784076) using assay buffer...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2VT1W7X
More data for this
Ligand-Target Pair