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SMILES: COc1cc2ncnc(N3CCC(CC[S@@](C)(=N)=O)CC3)c2cc1Cl

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 = 624571   
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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1


(Homo sapiens (Human))
BDBM624571
PNG
(US11780849, Compound 142b)
Show SMILES COc1cc2ncnc(N3CCC(CC[S@@](C)(=N)=O)CC3)c2cc1Cl |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
<3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1


(Homo sapiens (Human))
BDBM624571
PNG
(US11780849, Compound 142b)
Show SMILES COc1cc2ncnc(N3CCC(CC[S@@](C)(=N)=O)CC3)c2cc1Cl |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
800n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair