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BDBM67054 (2R)-2-allylsuccinic acid O1-[(2S)-2-[[(2S)-2-[2-[[(1R)-1-benzyl-2-hydroxy-ethyl]amino]-2-keto-ethyl]pent-4-enoyl]amino]-3-phenyl-propyl] ester O4-tert-butyl ester::(2R)-2-prop-2-enylbutanedioic acid O4-tert-butyl ester O1-[(2S)-2-[[(2S)-2-[2-[[(2R)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]-3-phenylpropyl] ester::4-O-tert-butyl 1-O-[(2S)-2-[[(2S)-2-[2-[[(2R)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]pent-4-enoyl]amino]-3-phenylpropyl] (2R)-2-prop-2-enylbutanedioate::MLS002320301::O4-tert-butyl O1-[(2S)-2-[[(2S)-2-[2-oxidanylidene-2-[[(2R)-1-oxidanyl-3-phenyl-propan-2-yl]amino]ethyl]pent-4-enoyl]amino]-3-phenyl-propyl] (2R)-2-prop-2-enylbutanedioate::SMR001337926::cid_44201802

SMILES: CC(C)(C)OC(=O)C[C@@H](CC=C)C(=O)OC[C@H](Cc1ccccc1)NC(=O)[C@@H](CC=C)CC(=O)N[C@@H](CO)Cc1ccccc1

InChI Key: InChIKey=QQUMCRNRBXZTAY-KQFVITFDSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 67054   
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
Bcl-2-like protein 11


(Homo sapiens (Human))		BDBM67054
PNG
((2R)-2-allylsuccinic acid O1-[(2S)-2-[[(2S)-2-[2-[...)
Show SMILES CC(C)(C)OC(=O)C[C@@H](CC=C)C(=O)OC[C@H](Cc1ccccc1)NC(=O)[C@@H](CC=C)CC(=O)N[C@@H](CO)Cc1ccccc1
Show InChI InChI=1S/C36H48N2O7/c1-6-14-28(22-32(40)37-30(24-39)20-26-16-10-8-11-17-26)34(42)38-31(21-27-18-12-9-13-19-27)25-44-35(43)29(15-7-2)23-33(41)45-36(3,4)5/h6-13,16-19,28-31,39H,1-2,14-15,20-25H2,3-5H3,(H,37,40)(H,38,42)/t28-,29+,30+,31-/m0/s1
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Similars
PCBioAssay
n/an/an/an/a>3.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24J0CKJ
More data for this
Ligand-Target Pair