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SMILES: N[C@@H]1c2ccccc2CC11CCN(CC1)c1cnc(SCC2CCCC2)cn1

InChI Key: InChIKey=BEFMNXHFMSTBRQ-JOCHJYFZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 485013   
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)		BDBM485013
PNG
(US10934302, Example 264)
Show SMILES N[C@@H]1c2ccccc2CC11CCN(CC1)c1cnc(SCC2CCCC2)cn1 |r|
Show InChI InChI=1S/C23H30N4S/c24-22-19-8-4-3-7-18(19)13-23(22)9-11-27(12-10-23)20-14-26-21(15-25-20)28-16-17-5-1-2-6-17/h3-4,7-8,14-15,17,22H,1-2,5-6,9-13,16,24H2/t22-/m1/s1
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PC cid
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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