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BDBM50188382 2,3-dioxo-1-propylindoline-5-carboxamide::CHEMBL210525

SMILES: CCCN1C(=O)C(=O)c2cc(ccc12)C(N)=O

InChI Key: InChIKey=UPFRLUKDHMINPH-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50188382   
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
Papain-like protease (PLpro)


(Human SARS coronavirus (SARS-CoV))
BDBM50188382
PNG
(2,3-dioxo-1-propylindoline-5-carboxamide | CHEMBL2...)
Show SMILES CCCN1C(=O)C(=O)c2cc(ccc12)C(N)=O
Show InChI InChI=1S/C12H12N2O3/c1-2-5-14-9-4-3-7(11(13)16)6-8(9)10(15)12(14)17/h3-4,6H,2,5H2,1H3,(H2,13,16)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of SARS CoV 3C-like protease


J Med Chem 49: 3440-3 (2006)


Article DOI: 10.1021/jm0602357
BindingDB Entry DOI: 10.7270/Q2TD9WZX
More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(2019-nCoV)
BDBM50188382
PNG
(2,3-dioxo-1-propylindoline-5-carboxamide | CHEMBL2...)
Show SMILES CCCN1C(=O)C(=O)c2cc(ccc12)C(N)=O
Show InChI InChI=1S/C12H12N2O3/c1-2-5-14-9-4-3-7(11(13)16)6-8(9)10(15)12(14)17/h3-4,6H,2,5H2,1H3,(H2,13,16)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

n/an/a 1.02E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3C-like proteinase (3CL-PRO)


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)
BDBM50188382
PNG
(2,3-dioxo-1-propylindoline-5-carboxamide | CHEMBL2...)
Show SMILES CCCN1C(=O)C(=O)c2cc(ccc12)C(N)=O
Show InChI InChI=1S/C12H12N2O3/c1-2-5-14-9-4-3-7(11(13)16)6-8(9)10(15)12(14)17/h3-4,6H,2,5H2,1H3,(H2,13,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

n/an/a 2.50E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair