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BDBM50382563 CHEMBL2023004

SMILES: N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1cccc(O)c1)C(O)=O

InChI Key: InChIKey=YRZUVFQUSAVADR-FQEVSTJZSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50382563   
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
Kinesin-like protein 1


(Homo sapiens (Human))
BDBM50382563
PNG
(CHEMBL2023004)
Show SMILES N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1cccc(O)c1)C(O)=O |r|
Show InChI InChI=1S/C22H21NO3S/c23-20(21(25)26)15-27-22(16-8-3-1-4-9-16,17-10-5-2-6-11-17)18-12-7-13-19(24)14-18/h1-14,20,24H,15,23H2,(H,25,26)/t20-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
48.8n/an/an/an/an/an/an/an/a



The Beatson Institute for Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of N-terminal hexa-histidine tagged human cloned Eg5 (1 to 368 amino acids) expressed in Escherichia coli BL21 (DE3) assessed as reduction...


J Med Chem 55: 1511-25 (2012)


Article DOI: 10.1021/jm201195m
BindingDB Entry DOI: 10.7270/Q2CZ386T
More data for this
Ligand-Target Pair