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BDBM50177955 2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyphenyl)acryloylamino]ethyl}-3-(3,4-dihydroxy-5-methoxyphenyl)acrylamide::CHEMBL198915

SMILES: COc1cc(\C=C(/C#N)C(=O)NCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O

InChI Key: InChIKey=GHHPOUGOEFAMFV-IAGONARPSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50177955   
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
Dynamin-1


(Homo sapiens (Human))
BDBM50177955
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyph...)
Show SMILES COc1cc(\C=C(/C#N)C(=O)NCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C24H22N4O8/c1-35-19-9-13(7-17(29)21(19)31)5-15(11-25)23(33)27-3-4-28-24(34)16(12-26)6-14-8-18(30)22(32)20(10-14)36-2/h5-10,29-32H,3-4H2,1-2H3,(H,27,33)(H,28,34)/b15-5+,16-6+
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair