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SMILES: CC1CCCN(C1)C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=QWYULBQCYGUSGL-UHFFFAOYSA-N

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 4 hits for monomerid = 50072858   
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
Serine protease 1


(Bos taurus (bovine))
BDBM50072858
PNG
(3-[3-(3-Methyl-piperidin-1-yl)-2-(naphthalene-2-su...)
Show SMILES CC1CCCN(C1)C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H30N4O3S/c1-18-6-5-13-30(17-18)26(31)24(15-19-7-4-10-22(14-19)25(27)28)29-34(32,33)23-12-11-20-8-2-3-9-21(20)16-23/h2-4,7-12,14,16,18,24,29H,5-6,13,15,17H2,1H3,(H3,27,28)
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KEGG

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PC cid
PC sid
UniChem

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Article
PubMed
530n/an/an/an/an/an/an/an/a



Institut für Biochemie

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine trypsin expressed as dissociation constant


J Med Chem 41: 5445-56 (1999)


Article DOI: 10.1021/jm981068g
BindingDB Entry DOI: 10.7270/Q2KK99ZF
More data for this
Ligand-Target Pair
Prothrombin


(Bos taurus (Bovine))
BDBM50072858
PNG
(3-[3-(3-Methyl-piperidin-1-yl)-2-(naphthalene-2-su...)
Show SMILES CC1CCCN(C1)C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H30N4O3S/c1-18-6-5-13-30(17-18)26(31)24(15-19-7-4-10-22(14-19)25(27)28)29-34(32,33)23-12-11-20-8-2-3-9-21(20)16-23/h2-4,7-12,14,16,18,24,29H,5-6,13,15,17H2,1H3,(H3,27,28)
PDB

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PC cid
PC sid
UniChem

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Article
PubMed
130n/an/an/an/an/an/an/an/a



Institut für Biochemie

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine thrombin expressed as dissociation constant


J Med Chem 41: 5445-56 (1999)


Article DOI: 10.1021/jm981068g
BindingDB Entry DOI: 10.7270/Q2KK99ZF
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50072858
PNG
(3-[3-(3-Methyl-piperidin-1-yl)-2-(naphthalene-2-su...)
Show SMILES CC1CCCN(C1)C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H30N4O3S/c1-18-6-5-13-30(17-18)26(31)24(15-19-7-4-10-22(14-19)25(27)28)29-34(32,33)23-12-11-20-8-2-3-9-21(20)16-23/h2-4,7-12,14,16,18,24,29H,5-6,13,15,17H2,1H3,(H3,27,28)
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Article
PubMed
3.50E+4n/an/an/an/an/an/an/an/a



Institut für Biochemie

Curated by ChEMBL


Assay Description
Inhibitory activity against human urokinase plasminogen activator expressed as dissociation constant


J Med Chem 41: 5445-56 (1999)


Article DOI: 10.1021/jm981068g
BindingDB Entry DOI: 10.7270/Q2KK99ZF
More data for this
Ligand-Target Pair
Coagulation factor X


(Bos taurus)
BDBM50072858
PNG
(3-[3-(3-Methyl-piperidin-1-yl)-2-(naphthalene-2-su...)
Show SMILES CC1CCCN(C1)C(=O)C(Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H30N4O3S/c1-18-6-5-13-30(17-18)26(31)24(15-19-7-4-10-22(14-19)25(27)28)29-34(32,33)23-12-11-20-8-2-3-9-21(20)16-23/h2-4,7-12,14,16,18,24,29H,5-6,13,15,17H2,1H3,(H3,27,28)
PDB
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UniChem

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Article
PubMed
3.20E+4n/an/an/an/an/an/an/an/a



Institut für Biochemie

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine coagulation factor X expressed as dissociation constant


J Med Chem 41: 5445-56 (1999)


Article DOI: 10.1021/jm981068g
BindingDB Entry DOI: 10.7270/Q2KK99ZF
More data for this
Ligand-Target Pair