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BDBM50099929 5-Methylsulfanyl-4-[4-(4-nitro-phenyl)-thiazol-2-yl]-thiophene-2-carboxamidine::CHEMBL29006

SMILES: CSc1sc(cc1-c1nc(cs1)-c1ccc(cc1)[N+]([O-])=O)C(N)=N

InChI Key: InChIKey=IHVADESBZZCEJN-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50099929   
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
Complement C1s


(Homo sapiens (Human))
BDBM50099929
PNG
(5-Methylsulfanyl-4-[4-(4-nitro-phenyl)-thiazol-2-y...)
Show SMILES CSc1sc(cc1-c1nc(cs1)-c1ccc(cc1)[N+]([O-])=O)C(N)=N
Show InChI InChI=1S/C15H12N4O2S3/c1-22-15-10(6-12(24-15)13(16)17)14-18-11(7-23-14)8-2-4-9(5-3-8)19(20)21/h2-7H,1H3,(H3,16,17)
PDB
MMDB

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CHEMBL
PC cid
PC sid
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Patents


Similars

Article
PubMed
1.00E+3n/an/an/an/an/an/an/an/a



3-Dimensional Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Complement C1s subcomponent


Bioorg Med Chem Lett 14: 3043-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.034
BindingDB Entry DOI: 10.7270/Q2K35T33
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50099929
PNG
(5-Methylsulfanyl-4-[4-(4-nitro-phenyl)-thiazol-2-y...)
Show SMILES CSc1sc(cc1-c1nc(cs1)-c1ccc(cc1)[N+]([O-])=O)C(N)=N
Show InChI InChI=1S/C15H12N4O2S3/c1-22-15-10(6-12(24-15)13(16)17)14-18-11(7-23-14)8-2-4-9(5-3-8)19(20)21/h2-7H,1H3,(H3,16,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents


Similars

PubMed
2.70E+5n/an/an/an/an/an/an/an/a



3-Dimensional Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against serine protease urokinase-type plasminogen activator (microPa)


Bioorg Med Chem Lett 11: 1379-82 (2001)


BindingDB Entry DOI: 10.7270/Q24M93S1
More data for this
Ligand-Target Pair