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BDBM50074716 CHEMBL438943::Lys-Pro-Phe-pTyr-Val-Asn-Val-Glu-Phe

SMILES: CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=NQEUDXBNCYJDFJ-CKNONNRWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50074716   
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
Grb2-SH2


(Homo sapiens (Human))		BDBM50074716
PNG
(CHEMBL438943 | Lys-Pro-Phe-pTyr-Val-Asn-Val-Glu-Ph...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C57H80N11O17P/c1-32(2)47(54(77)61-39(24-25-46(70)71)49(72)65-43(57(80)81)30-35-16-9-6-10-17-35)67-52(75)42(31-45(60)69)64-55(78)48(33(3)4)66-51(74)41(29-36-20-22-37(23-21-36)85-86(82,83)84)62-50(73)40(28-34-14-7-5-8-15-34)63-53(76)44-19-13-27-68(44)56(79)38(59)18-11-12-26-58/h5-10,14-17,20-23,32-33,38-44,47-48H,11-13,18-19,24-31,58-59H2,1-4H3,(H2,60,69)(H,61,77)(H,62,73)(H,63,76)(H,64,78)(H,65,72)(H,66,74)(H,67,75)(H,70,71)(H,80,81)(H2,82,83,84)/t38-,39-,40-,41-,42-,43-,44-,47-,48-/m0/s1
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KEGG

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UniProtKB/TrEMBL

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n/an/a 140n/an/an/an/an/an/a



Novartis Forschungsinstitut

Curated by ChEMBL


Assay Description
Inhibitory activity against binding of Growth factor receptor bound protein 2 to biotinylated KPFY*VNVEF Peptide by ELISA.

J Med Chem 42: 971-80 (1999)


Article DOI: 10.1021/jm9811007
BindingDB Entry DOI: 10.7270/Q28S4P35
More data for this
Ligand-Target Pair