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SMILES: [H][C@]12CCC(=C[C@]1([H])[C@H](CC[C@@H]2C)C(C)=C)C(O)=O

InChI Key:

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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 = 50553891   
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
Cocaine esterase


(Homo sapiens (Human))
BDBM50553891
PNG
(CHEMBL4763518)
Show SMILES [H][C@]12CCC(=C[C@]1([H])[C@H](CC[C@@H]2C)C(C)=C)C(O)=O |r,c:4|
NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CES2A1 in human liver microsomes using D-luciferin methyl ester as substrate preincubated for 10 mins followed by substrate addition an...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c00464
BindingDB Entry DOI: 10.7270/Q2BG2SMW
More data for this
Ligand-Target Pair