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SMILES: CSCC[C@H](NC(=O)c1ccc(\C=C\c2ccc(Oc3ccccc3)nc2)cc1-c1ccccc1C)C(O)=O

InChI Key: InChIKey=VNGJGARSHMJYAY-SYJLOCQFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50075860   
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
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))		BDBM50075860
PNG
((S)-2-({2'-Methyl-5-[2-((E)-6-phenoxy-pyridin-3-yl...)
Show SMILES CSCC[C@H](NC(=O)c1ccc(\C=C\c2ccc(Oc3ccccc3)nc2)cc1-c1ccccc1C)C(O)=O
Show InChI InChI=1S/C32H30N2O4S/c1-22-8-6-7-11-26(22)28-20-23(14-16-27(28)31(35)34-29(32(36)37)18-19-39-2)12-13-24-15-17-30(33-21-24)38-25-9-4-3-5-10-25/h3-17,20-21,29H,18-19H2,1-2H3,(H,34,35)(H,36,37)/b13-12+/t29-/m0/s1
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n/an/a 26n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against farnesyltransferase (FT) using SPA assay

Bioorg Med Chem Lett 9: 703-8 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CWQ
More data for this
Ligand-Target Pair