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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50080476   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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Article
PubMed
78n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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antibodypedia
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Article
PubMed
1.20E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Anionic trypsin


(Bos taurus)
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
2.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair