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SMILES: CCOc1ccc(nc1)-c1nnc(n1-c1ccccn1)C12CC(C1)(C2)NC(=O)c1ccnc2cccnc12

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 = 50579968   
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
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM50579968
PNG
(CHEMBL5072404 | US11926614, Example 122)
Show SMILES CCOc1ccc(nc1)-c1nnc(n1-c1ccccn1)C12CC(C1)(C2)NC(=O)c1ccnc2cccnc12
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 13n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM50579968
PNG
(CHEMBL5072404 | US11926614, Example 122)
Show SMILES CCOc1ccc(nc1)-c1nnc(n1-c1ccccn1)C12CC(C1)(C2)NC(=O)c1ccnc2cccnc12
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 13n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human TNKS2 (873 to 1162 residues) incubated for 20 hrs in presence of NAD


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01264
BindingDB Entry DOI: 10.7270/Q21R6VDH
More data for this
Ligand-Target Pair