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BDBM16151 (2S)-2-[benzyl({4-chloro-1-[(diaminomethylidene)amino]isoquinoline-7-})sulfonamido]propanoic acid::substituted glycine deriv. 25

SMILES: [#6]-[#6@H](-[#7](-[#6]-c1ccccc1)S(=O)(=O)c1ccc2c(Cl)cnc(\[#7]=[#6](/[#7])-[#7])c2c1)-[#6](-[#8])=O

InChI Key: InChIKey=YQUVIYVFJDEFDB-LBPRGKRZSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 16151   
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))
BDBM16151
PNG
((2S)-2-[benzyl({4-chloro-1-[(diaminomethylidene)am...)
Show SMILES [#6]-[#6@H](-[#7](-[#6]-c1ccccc1)S(=O)(=O)c1ccc2c(Cl)cnc(\[#7]=[#6](/[#7])-[#7])c2c1)-[#6](-[#8])=O |r|
Show InChI InChI=1S/C20H20ClN5O4S/c1-12(19(27)28)26(11-13-5-3-2-4-6-13)31(29,30)14-7-8-15-16(9-14)18(25-20(22)23)24-10-17(15)21/h2-10,12H,11H2,1H3,(H,27,28)(H4,22,23,24,25)/t12-/m0/s1
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Similars

Article
PubMed
27n/an/an/an/an/an/an/an/a



Pfizer



Assay Description
Ki values for compounds were calculated by incubation of each enzyme with its substrate and various compound concentrations. Absorbance was read at 4...


J Med Chem 50: 2341-51 (2007)


Article DOI: 10.1021/jm061066t
BindingDB Entry DOI: 10.7270/Q27S7M18
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM16151
PNG
((2S)-2-[benzyl({4-chloro-1-[(diaminomethylidene)am...)
Show SMILES [#6]-[#6@H](-[#7](-[#6]-c1ccccc1)S(=O)(=O)c1ccc2c(Cl)cnc(\[#7]=[#6](/[#7])-[#7])c2c1)-[#6](-[#8])=O |r|
Show InChI InChI=1S/C20H20ClN5O4S/c1-12(19(27)28)26(11-13-5-3-2-4-6-13)31(29,30)14-7-8-15-16(9-14)18(25-20(22)23)24-10-17(15)21/h2-10,12H,11H2,1H3,(H,27,28)(H4,22,23,24,25)/t12-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



Pfizer



Assay Description
Ki values for compounds were calculated by incubation of each enzyme with its substrate and various compound concentrations. Absorbance was read at 4...


J Med Chem 50: 2341-51 (2007)


Article DOI: 10.1021/jm061066t
BindingDB Entry DOI: 10.7270/Q27S7M18
More data for this
Ligand-Target Pair