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BDBM50075976 CHEMBL165875::N-Methyl-4-nitro-N-(4-oxo-4H-benzo[d][1,3]oxazin-2-yl)-benzenesulfonamide

SMILES: CN(c1nc2ccccc2c(=O)o1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=RVBJLIXVRSKZML-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50075976   
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
Complement C1r subcomponent


(Homo sapiens (Human))
BDBM50075976
PNG
(CHEMBL165875 | N-Methyl-4-nitro-N-(4-oxo-4H-benzo[...)
Show SMILES CN(c1nc2ccccc2c(=O)o1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H11N3O6S/c1-17(15-16-13-5-3-2-4-12(13)14(19)24-15)25(22,23)11-8-6-10(7-9-11)18(20)21/h2-9H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 3.10E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of purified human C1r protease.


Bioorg Med Chem Lett 9: 815-20 (1999)


BindingDB Entry DOI: 10.7270/Q29G5M0K
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50075976
PNG
(CHEMBL165875 | N-Methyl-4-nitro-N-(4-oxo-4H-benzo[...)
Show SMILES CN(c1nc2ccccc2c(=O)o1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H11N3O6S/c1-17(15-16-13-5-3-2-4-12(13)14(19)24-15)25(22,23)11-8-6-10(7-9-11)18(20)21/h2-9H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro for inhibition of purified bovine trypsin.


Bioorg Med Chem Lett 9: 815-20 (1999)


BindingDB Entry DOI: 10.7270/Q29G5M0K
More data for this
Ligand-Target Pair