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BDBM50080451 CHEMBL3422267

SMILES: [H][C@@]1(O[C@@H](CCCCC)c2c(O)cc3C(=O)c4cc(O)cc(O)c4C(=O)c3c2O)O[C@@]([H])([C@H](O)CO)[C@H](O)[C@H]1O

InChI Key: InChIKey=UDEJSRNTKLJXPT-HQUGCNLOSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50080451   
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
CREB-binding protein/p53


(Homo sapiens (Human))
BDBM50080451
PNG
(CHEMBL3422267)
Show SMILES [H][C@@]1(O[C@@H](CCCCC)c2c(O)cc3C(=O)c4cc(O)cc(O)c4C(=O)c3c2O)O[C@@]([H])([C@H](O)CO)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C26H30O12/c1-2-3-4-5-16(37-26-24(36)23(35)25(38-26)15(31)9-27)19-14(30)8-12-18(22(19)34)21(33)17-11(20(12)32)6-10(28)7-13(17)29/h6-8,15-16,23-31,34-36H,2-5,9H2,1H3/t15-,16+,23-,24-,25+,26-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



Institute of Microbial Chemistry (BIKAKEN)

Curated by ChEMBL


Assay Description
Induction of p53-dependent growth suppression of human LNZTA3 cells after 72 hrs by MTT assay


J Nat Prod 78: 188-95 (2015)


Article DOI: 10.1021/np500581m
BindingDB Entry DOI: 10.7270/Q25B046Z
More data for this
Ligand-Target Pair