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SMILES: COc1cc(\C=C2/Cc3ccc(OC(C)C)cc3C2=O)ccc1O

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 2 hits for monomerid = 50552230   
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
Pancreatic triacylglycerol lipase


(Sus scrofa (Pig))
BDBM50552230
PNG
(CHEMBL4745825)
Show SMILES COc1cc(\C=C2/Cc3ccc(OC(C)C)cc3C2=O)ccc1O
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 8.61E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cocaine esterase


(Homo sapiens (Human))
BDBM50552230
PNG
(CHEMBL4745825)
Show SMILES COc1cc(\C=C2/Cc3ccc(OC(C)C)cc3C2=O)ccc1O
NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 2.86E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair