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BDBM50088985 CHEMBL369042::{2-[2-(1-Carbamimidoyl-2-hydroxy-piperidin-3-ylcarbamoyl)-pyrrolidin-1-yl]-1-hydroxymethyl-2-oxo-ethyl}-carbamic acid benzyl ester

SMILES: NC(=N)N1CCCC(NC(=O)[C@H]2CCCN2C(=O)C(CO)NC(=O)OCc2ccccc2)C1O

InChI Key: InChIKey=RFUDJRCNYAUEMT-APUKJBRXSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50088985   
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
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50088985
PNG
(CHEMBL369042 | {2-[2-(1-Carbamimidoyl-2-hydroxy-pi...)
Show SMILES NC(=N)N1CCCC(NC(=O)[C@H]2CCCN2C(=O)C(CO)NC(=O)OCc2ccccc2)C1O
Show InChI InChI=1S/C22H32N6O6/c23-21(24)28-11-4-8-15(19(28)31)25-18(30)17-9-5-10-27(17)20(32)16(12-29)26-22(33)34-13-14-6-2-1-3-7-14/h1-3,6-7,15-17,19,29,31H,4-5,8-13H2,(H3,23,24)(H,25,30)(H,26,33)/t15?,16?,17-,19?/m1/s1
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Article
PubMed
n/an/a>2.50E+3n/an/an/an/an/an/a



Corvas International Inc

Curated by ChEMBL


Assay Description
The compound was tested in vitro for its inhibitory activity against human t-PA enzyme, activity expressed as IC50


Bioorg Med Chem Lett 10: 983-7 (2000)


Article DOI: 10.1016/s0960-894x(00)00149-9
BindingDB Entry DOI: 10.7270/Q2765DKB
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50088985
PNG
(CHEMBL369042 | {2-[2-(1-Carbamimidoyl-2-hydroxy-pi...)
Show SMILES NC(=N)N1CCCC(NC(=O)[C@H]2CCCN2C(=O)C(CO)NC(=O)OCc2ccccc2)C1O
Show InChI InChI=1S/C22H32N6O6/c23-21(24)28-11-4-8-15(19(28)31)25-18(30)17-9-5-10-27(17)20(32)16(12-29)26-22(33)34-13-14-6-2-1-3-7-14/h1-3,6-7,15-17,19,29,31H,4-5,8-13H2,(H3,23,24)(H,25,30)(H,26,33)/t15?,16?,17-,19?/m1/s1
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Article
PubMed
n/an/a 12n/an/an/an/an/an/a



Corvas International Inc

Curated by ChEMBL


Assay Description
The compound was tested in vitro for its inhibitory activity against human urokinase enzyme, activity expressed as IC50


Bioorg Med Chem Lett 10: 983-7 (2000)


Article DOI: 10.1016/s0960-894x(00)00149-9
BindingDB Entry DOI: 10.7270/Q2765DKB
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50088985
PNG
(CHEMBL369042 | {2-[2-(1-Carbamimidoyl-2-hydroxy-pi...)
Show SMILES NC(=N)N1CCCC(NC(=O)[C@H]2CCCN2C(=O)C(CO)NC(=O)OCc2ccccc2)C1O
Show InChI InChI=1S/C22H32N6O6/c23-21(24)28-11-4-8-15(19(28)31)25-18(30)17-9-5-10-27(17)20(32)16(12-29)26-22(33)34-13-14-6-2-1-3-7-14/h1-3,6-7,15-17,19,29,31H,4-5,8-13H2,(H3,23,24)(H,25,30)(H,26,33)/t15?,16?,17-,19?/m1/s1
PDB
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NCI pathway
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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 125n/an/an/an/an/an/a



Corvas International Inc

Curated by ChEMBL


Assay Description
The compound was tested in vitro for its inhibitory activity against human Plasmin enzyme, activity expressed as IC50


Bioorg Med Chem Lett 10: 983-7 (2000)


Article DOI: 10.1016/s0960-894x(00)00149-9
BindingDB Entry DOI: 10.7270/Q2765DKB
More data for this
Ligand-Target Pair