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BDBM50147053 5-Methylsulfanyl-4-(5-phenyl-thiazol-2-yl)-thiophene-2-carboxamidine::CHEMBL322672

SMILES: CSc1sc(cc1-c1ncc(s1)-c1ccccc1)C(N)=N

InChI Key: InChIKey=BBOOVCSXOALWHH-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50147053   
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))
BDBM50147053
PNG
(5-Methylsulfanyl-4-(5-phenyl-thiazol-2-yl)-thiophe...)
Show SMILES CSc1sc(cc1-c1ncc(s1)-c1ccccc1)C(N)=N
Show InChI InChI=1S/C15H13N3S3/c1-19-15-10(7-11(21-15)13(16)17)14-18-8-12(20-14)9-5-3-2-4-6-9/h2-8H,1H3,(H3,16,17)
PDB
MMDB

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Similars

Article
PubMed
3.25E+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