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BDBM50014339 1N-amino(immino)methyl-4-nitroaniline

SMILES: NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=TYWHSGIYNMFJBG-UHFFFAOYSA-O

Data: 5 KI

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 5 hits for monomerid = 50014339   
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
Urokinase-type plasminogen activator/surface receptor


(Homo sapiens (Human))
BDBM50014339
PNG
(1N-amino(immino)methyl-4-nitroaniline)
Show SMILES NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C7H8N4O2/c8-7(9)10-5-1-3-6(4-2-5)11(12)13/h1-4H,(H4,8,9,10)/p+1
PDB
MMDB

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2.06E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition against Urokinase-type plasminogen activator


J Med Chem 33: 2956-61 (1990)


BindingDB Entry DOI: 10.7270/Q2GB24NB
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50014339
PNG
(1N-amino(immino)methyl-4-nitroaniline)
Show SMILES NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C7H8N4O2/c8-7(9)10-5-1-3-6(4-2-5)11(12)13/h1-4H,(H4,8,9,10)/p+1
PDB
MMDB

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2.06E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition against Urokinase-type plasminogen activator


J Med Chem 33: 2956-61 (1990)


BindingDB Entry DOI: 10.7270/Q2GB24NB
More data for this
Ligand-Target Pair
Trypsin I


(Bos taurus (bovine))
BDBM50014339
PNG
(1N-amino(immino)methyl-4-nitroaniline)
Show SMILES NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C7H8N4O2/c8-7(9)10-5-1-3-6(4-2-5)11(12)13/h1-4H,(H4,8,9,10)/p+1
PDB
MMDB

KEGG

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B.MOAD
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PC cid
PC sid
UniChem
PubMed
3.52E+5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition against Trypsin


J Med Chem 33: 2956-61 (1990)


BindingDB Entry DOI: 10.7270/Q2GB24NB
More data for this
Ligand-Target Pair
Trypsin


(Bos taurus (bovine))
BDBM50014339
PNG
(1N-amino(immino)methyl-4-nitroaniline)
Show SMILES NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C7H8N4O2/c8-7(9)10-5-1-3-6(4-2-5)11(12)13/h1-4H,(H4,8,9,10)/p+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PubMed
3.52E+5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition against Trypsin


J Med Chem 33: 2956-61 (1990)


BindingDB Entry DOI: 10.7270/Q2GB24NB
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50014339
PNG
(1N-amino(immino)methyl-4-nitroaniline)
Show SMILES NC(=[NH2+])Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C7H8N4O2/c8-7(9)10-5-1-3-6(4-2-5)11(12)13/h1-4H,(H4,8,9,10)/p+1
PDB
MMDB

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<1.00E+7n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition against human plasmin was determined at 0.5 mM


J Med Chem 33: 2956-61 (1990)


BindingDB Entry DOI: 10.7270/Q2GB24NB
More data for this
Ligand-Target Pair