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SMILES: CC(C)[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)C2(CCCCC2)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)CSC[C@H](NC1=O)C(N)=O

InChI Key: InChIKey=XNJGRGUYRZTSMC-CIEVZJJWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50294418   
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
Growth factor receptor-bound protein 2


(Homo sapiens (Human))		BDBM50294418
PNG
(4-{[(9S,15R,18S,21S)-15-carbamoyl-21-(carbamoylmet...)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)C2(CCCCC2)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)CSC[C@H](NC1=O)C(N)=O |r|
Show InChI InChI=1S/C30H44N7O11PS/c1-16(2)24-28(43)34-21(25(32)40)14-50-15-23(39)33-19(12-17-6-8-18(9-7-17)48-49(45,46)47)27(42)37-30(10-4-3-5-11-30)29(44)35-20(13-22(31)38)26(41)36-24/h6-9,16,19-21,24H,3-5,10-15H2,1-2H3,(H2,31,38)(H2,32,40)(H,33,39)(H,34,43)(H,35,44)(H,36,41)(H,37,42)(H2,45,46,47)/t19-,20-,21-,24-/m0/s1
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KEGG

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Similars
Article
PubMed
n/an/an/a 1.42E+3n/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to GST-tagged recombinant Grb2 SH2 domain by Biacore assay

Bioorg Med Chem Lett 19: 2693-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.134
BindingDB Entry DOI: 10.7270/Q2862HC2
More data for this
Ligand-Target Pair