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

InChI Key:

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50552215   
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))
BDBM50552215
PNG
(CHEMBL4751728)
Show SMILES COc1cc(\C=C2/Cc3ccc(N)cc3C2=O)ccc1O
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.24E+4n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmc.2020.115853
BindingDB Entry DOI: 10.7270/Q2DV1PJS
More data for this
Ligand-Target Pair
Cocaine esterase


(Homo sapiens (Human))
BDBM50552215
PNG
(CHEMBL4751728)
Show SMILES COc1cc(\C=C2/Cc3ccc(N)cc3C2=O)ccc1O
NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.48E+3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112856
BindingDB Entry DOI: 10.7270/Q2NZ8CB7
More data for this
Ligand-Target Pair