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BDBM50092660 4-Amino-benzamidine::4-aminobenzamidine::CHEMBL124632::CHEMBL545184::p-aminobenzamidine

SMILES: NC(=N)c1ccc(N)cc1

InChI Key: InChIKey=WPANETAWYGDRLL-UHFFFAOYSA-N

Data: 3 KI  1 IC50  1 Kd

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 = 50092660   
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
Trypsin-1


(Homo sapiens (Human))
BDBM50092660
PNG
(4-Amino-benzamidine | 4-aminobenzamidine | CHEMBL1...)
Show SMILES NC(=N)c1ccc(N)cc1
Show InChI InChI=1S/C7H9N3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H3,9,10)
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Article
PubMed
8.90E+3n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant trypsin 1 using tosyl-GPR-pNA substrate by spectrophotometry


Bioorg Med Chem Lett 22: 4839-43 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.046
BindingDB Entry DOI: 10.7270/Q2QV3NKC
More data for this
Ligand-Target Pair
Trypsin


(Homo sapiens (Human))
BDBM50092660
PNG
(4-Amino-benzamidine | 4-aminobenzamidine | CHEMBL1...)
Show SMILES NC(=N)c1ccc(N)cc1
Show InChI InChI=1S/C7H9N3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H3,9,10)
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Article
PubMed
1.31E+4n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant trypsin 4 using tosyl-GPR-pNA substrate by spectrophotometry


Bioorg Med Chem Lett 22: 4839-43 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.046
BindingDB Entry DOI: 10.7270/Q2QV3NKC
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50092660
PNG
(4-Amino-benzamidine | 4-aminobenzamidine | CHEMBL1...)
Show SMILES NC(=N)c1ccc(N)cc1
Show InChI InChI=1S/C7H9N3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H3,9,10)
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Article
PubMed
9.50E+4n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human thrombin using tosyl-GPR-pNA substrate by spectrophotometry


Bioorg Med Chem Lett 22: 4839-43 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.046
BindingDB Entry DOI: 10.7270/Q2QV3NKC
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50092660
PNG
(4-Amino-benzamidine | 4-aminobenzamidine | CHEMBL1...)
Show SMILES NC(=N)c1ccc(N)cc1
Show InChI InChI=1S/C7H9N3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H3,9,10)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 7.80E+4n/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Binding affinity to human alpha thrombin by Biocore A100 assay


Bioorg Med Chem Lett 22: 4839-43 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.046
BindingDB Entry DOI: 10.7270/Q2QV3NKC
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50092660
PNG
(4-Amino-benzamidine | 4-aminobenzamidine | CHEMBL1...)
Show SMILES NC(=N)c1ccc(N)cc1
Show InChI InChI=1S/C7H9N3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H3,9,10)
PDB
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CHEMBL
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PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Urokinase-type plasminogen activator


J Med Chem 43: 3862-6 (2000)


BindingDB Entry DOI: 10.7270/Q2VD6XQC
More data for this
Ligand-Target Pair