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BDBM50014326 1N-amino(immino)methyl-4-ethylaniline

SMILES: CCc1ccc(NC(N)=[NH2+])cc1

InChI Key: InChIKey=UOSZGPBYQCNGKB-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 = 50014326   
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


(Homo sapiens (Human))
BDBM50014326
PNG
(1N-amino(immino)methyl-4-ethylaniline)
Show SMILES CCc1ccc(NC(N)=[NH2+])cc1
Show InChI InChI=1S/C9H13N3/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H4,10,11,12)/p+1
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PubMed
9.07E+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/surface receptor


(Homo sapiens (Human))
BDBM50014326
PNG
(1N-amino(immino)methyl-4-ethylaniline)
Show SMILES CCc1ccc(NC(N)=[NH2+])cc1
Show InChI InChI=1S/C9H13N3/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H4,10,11,12)/p+1
PDB
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PubMed
9.08E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
log1/Ki value was calculated 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


(Bos taurus (bovine))
BDBM50014326
PNG
(1N-amino(immino)methyl-4-ethylaniline)
Show SMILES CCc1ccc(NC(N)=[NH2+])cc1
Show InChI InChI=1S/C9H13N3/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H4,10,11,12)/p+1
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PubMed
5.77E+6n/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 I


(Bos taurus (bovine))
BDBM50014326
PNG
(1N-amino(immino)methyl-4-ethylaniline)
Show SMILES CCc1ccc(NC(N)=[NH2+])cc1
Show InChI InChI=1S/C9H13N3/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H4,10,11,12)/p+1
PDB
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KEGG

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B.MOAD
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MCE
PC cid
PC sid
UniChem

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Similars

PubMed
5.77E+6n/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))
BDBM50014326
PNG
(1N-amino(immino)methyl-4-ethylaniline)
Show SMILES CCc1ccc(NC(N)=[NH2+])cc1
Show InChI InChI=1S/C9H13N3/c1-2-7-3-5-8(6-4-7)12-9(10)11/h3-6H,2H2,1H3,(H4,10,11,12)/p+1
PDB
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PubMed
<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