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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50002918   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Vascular endothelial growth factor A


(Homo sapiens (Human))		BDBM50002918
PNG
(Apratoxin S4)
Show SMILES [H][C@]12CSC(=N1)[C@@H](C)[C@@H](O)C[C@H](C)C[C@H](OC(=O)[C@]1([H])CCCN1C(=O)[C@]([H])([C@@H](C)CC)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)CC2)C(C)(C)C |r,c:4|
Show InChI InChI=1S/C44H69N5O8S/c1-12-27(3)38-42(54)49-21-13-14-34(49)43(55)57-36(44(6,7)8)23-26(2)22-35(50)28(4)39-45-31(25-58-39)17-20-37(51)46-33(24-30-15-18-32(56-11)19-16-30)41(53)47(9)29(5)40(52)48(38)10/h15-16,18-19,26-29,31,33-36,38,50H,12-14,17,20-25H2,1-11H3,(H,46,51)/t26-,27-,28-,29-,31-,33-,34-,35-,36-,38-/m0/s1
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Similars
Article
PubMed
n/an/a 0.320n/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Inhibition of VEGF-A production in human HCT116 cells after 12 hrs by alphaLISA assay

J Med Chem 57: 3011-29 (2014)


Article DOI: 10.1021/jm4019965
BindingDB Entry DOI: 10.7270/Q2154JKD
More data for this
Ligand-Target Pair