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BDBM93094 2-Guanidino-4-methylguinazoline

SMILES: Cc1nc(NC(N)=N)nc2ccccc12

InChI Key: InChIKey=JOIHHBBRWFFSMK-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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   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 = 93094   
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))
BDBM93094
PNG
(2-Guanidino-4-methylguinazoline)
Show SMILES Cc1nc(NC(N)=N)nc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-6-7-4-2-3-5-8(7)14-10(13-6)15-9(11)12/h2-5H,1H3,(H4,11,12,13,14,15)/q+1
PDB
MMDB

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MCE
PC cid
PC sid
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Similars

Article
PubMed
7.65E+4 -5.62n/an/an/an/an/a8.0525.5



Michigan State University



Assay Description
All readings were made in a Hitachi-Coleman ultraviolet-visible 101 spectrophotometer.


Biochemistry 8: 4503-10 (1969)


Article DOI: 10.1021/bi00839a042
BindingDB Entry DOI: 10.7270/Q22R3Q87
More data for this
Ligand-Target Pair
Myeloperoxidase


(Homo sapiens (Human))
BDBM93094
PNG
(2-Guanidino-4-methylguinazoline)
Show SMILES Cc1nc(NC(N)=N)nc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-6-7-4-2-3-5-8(7)14-10(13-6)15-9(11)12/h2-5H,1H3,(H4,11,12,13,14,15)/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Universit£ Libre de Bruxelles

Curated by ChEMBL


Assay Description
Inhibition of recombinant MPO (unknown origin) assessed as reduction in taurine chloramine production preincubated with enzyme and taurine followed b...


J Med Chem 60: 6563-6586 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00285
BindingDB Entry DOI: 10.7270/Q27D2XD7
More data for this
Ligand-Target Pair