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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'X-box-binding protein 1' and Ligand = 'BDBM50131222'   
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
X-box-binding protein 1


(Rattus norvegicus)		BDBM50131222
PNG
(CHEMBL3634662)
Show SMILES [H][C@@]12C[C@@]3(CC[C@@](C)(O3)[C@H](O)CC(=O)\C(C)=C\CC[C@@]1(C)O2)C(C)C |r,t:16|
Show InChI InChI=1S/C20H32O4/c1-13(2)20-10-9-18(4,24-20)16(22)11-15(21)14(3)7-6-8-19(5)17(12-20)23-19/h7,13,16-17,22H,6,8-12H2,1-5H3/b14-7+/t16-,17-,18-,19-,20+/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
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Similars
Article
PubMed
n/an/an/an/a 420n/an/an/an/a



Chinese Academy of Medical Sciences and Peking Union Medical College

Curated by ChEMBL


Assay Description
Transactivation of XBP1 in rat IEC-6 cells after 48 hrs by dual luciferase reporter gene assay

J Nat Prod 78: 2322-31 (2015)


Article DOI: 10.1021/acs.jnatprod.5b00104
BindingDB Entry DOI: 10.7270/Q2ZK5JGZ
More data for this
Ligand-Target Pair