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BDBM50461016 CHEMBL4226393

SMILES: CC(=O)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12

InChI Key: InChIKey=LDPDVNYCIOHPGF-UHFFFAOYSA-N

Data: 1 IC50  1 Kd

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 = 50461016   
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 14


(Homo sapiens (Human))
BDBM50461016
PNG
(CHEMBL4226393)
Show SMILES CC(=O)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12
Show InChI InChI=1S/C20H16N2O/c1-13(23)21-18-11-4-2-7-14(18)16-9-6-10-17-15-8-3-5-12-19(15)22-20(16)17/h2-12,22H,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

antibodypedia
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 860n/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression system by ITC assay


Bioorg Med Chem 26: 2965-2972 (2018)


Article DOI: 10.1016/j.bmc.2018.03.020
BindingDB Entry DOI: 10.7270/Q24T6N1Q
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461016
PNG
(CHEMBL4226393)
Show SMILES CC(=O)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12
Show InChI InChI=1S/C20H16N2O/c1-13(23)21-18-11-4-2-7-14(18)16-9-6-10-17-15-8-3-5-12-19(15)22-20(16)17/h2-12,22H,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 720n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)


Article DOI: 10.1016/j.bmc.2018.03.020
BindingDB Entry DOI: 10.7270/Q24T6N1Q
More data for this
Ligand-Target Pair