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SMILES: Cc1nc(N2CCC3(Cc4ccccc4[C@H]3N)CC2)c(CO)nc1-c1cccc(Cl)c1Cl

InChI Key: InChIKey=DKKQZPVCISDBHD-HSZRJFAPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 484771   
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
SH2B adapter protein 2


(Human)		BDBM484771
PNG
(US10934302, Example 20)
Show SMILES Cc1nc(N2CCC3(Cc4ccccc4[C@H]3N)CC2)c(CO)nc1-c1cccc(Cl)c1Cl |r|
Show InChI InChI=1S/C25H26Cl2N4O/c1-15-22(18-7-4-8-19(26)21(18)27)30-20(14-32)24(29-15)31-11-9-25(10-12-31)13-16-5-2-3-6-17(16)23(25)28/h2-8,23,32H,9-14,28H2,1H3/t23-/m1/s1
PDB
MMDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



Relay Therapeutics, Inc.

US Patent


Assay Description
SHP2 is allosterically activated through binding of bis-tyrosyl-phorphorylated peptides to its Src Homology 2 (SH2) domains. The latter activation st...

US Patent US10934302 (2021)


BindingDB Entry DOI: 10.7270/Q2ZW1Q1S
More data for this
Ligand-Target Pair