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BDBM50289009 2-(2-Iodo-benzyl)-benzo[d][1,3]oxazin-4-one::CHEMBL159104

SMILES: Ic1ccccc1Cc1nc2ccccc2c(=O)o1

InChI Key: InChIKey=PNXOPVCYIODAON-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50289009   
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))
BDBM50289009
PNG
(2-(2-Iodo-benzyl)-benzo[d][1,3]oxazin-4-one | CHEM...)
Show SMILES Ic1ccccc1Cc1nc2ccccc2c(=O)o1
Show InChI InChI=1S/C15H10INO2/c16-12-7-3-1-5-10(12)9-14-17-13-8-4-2-6-11(13)15(18)19-14/h1-8H,9H2
PDB
MMDB

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Article
n/an/a 4.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against C1r serine protease


Bioorg Med Chem Lett 6: 679-682 (1996)


Article DOI: 10.1016/0960-894X(96)00094-7
BindingDB Entry DOI: 10.7270/Q2P84BVF
More data for this
Ligand-Target Pair
Complement C1r


(Homo sapiens (Human))
BDBM50289009
PNG
(2-(2-Iodo-benzyl)-benzo[d][1,3]oxazin-4-one | CHEM...)
Show SMILES Ic1ccccc1Cc1nc2ccccc2c(=O)o1
Show InChI InChI=1S/C15H10INO2/c16-12-7-3-1-5-10(12)9-14-17-13-8-4-2-6-11(13)15(18)19-14/h1-8H,9H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 6.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of C1r serine protease


Bioorg Med Chem Lett 6: 679-682 (1996)


Article DOI: 10.1016/0960-894X(96)00094-7
BindingDB Entry DOI: 10.7270/Q2P84BVF
More data for this
Ligand-Target Pair
Complement C1r


(Homo sapiens (Human))
BDBM50289009
PNG
(2-(2-Iodo-benzyl)-benzo[d][1,3]oxazin-4-one | CHEM...)
Show SMILES Ic1ccccc1Cc1nc2ccccc2c(=O)o1
Show InChI InChI=1S/C15H10INO2/c16-12-7-3-1-5-10(12)9-14-17-13-8-4-2-6-11(13)15(18)19-14/h1-8H,9H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 2.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against C1r serine protease


Bioorg Med Chem Lett 6: 679-682 (1996)


Article DOI: 10.1016/0960-894X(96)00094-7
BindingDB Entry DOI: 10.7270/Q2P84BVF
More data for this
Ligand-Target Pair