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BDBM24962 [(2-aminoacetamido)methyl](methyl)phosphinic acid::organophosphorus derivative, 3

SMILES: CP(O)(=O)CNC(=O)CN

InChI Key: InChIKey=HYADWXPVUPESFA-UHFFFAOYSA-N

Data: 2 KI  2 IC50

PDB links: 3 PDB IDs contain this monomer as substructures. 3 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 24962   
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
Urea Amidohydrolase


(Bacillus pasteurii)
BDBM24962
PNG
([(2-aminoacetamido)methyl](methyl)phosphinic acid ...)
Show SMILES CP(O)(=O)CNC(=O)CN
Show InChI InChI=1S/C4H11N2O3P/c1-10(8,9)3-6-4(7)2-5/h2-3,5H2,1H3,(H,6,7)(H,8,9)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.10E+4 -6.48 6.00E+4n/an/an/an/a7.030



Wroclaw University of Technology



Assay Description
Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...


J Med Chem 51: 5736-44 (2008)


Article DOI: 10.1021/jm800570q
BindingDB Entry DOI: 10.7270/Q2PR7T91
More data for this
Ligand-Target Pair
Urea Amidohydrolase


(Proteus vulgaris)
BDBM24962
PNG
([(2-aminoacetamido)methyl](methyl)phosphinic acid ...)
Show SMILES CP(O)(=O)CNC(=O)CN
Show InChI InChI=1S/C4H11N2O3P/c1-10(8,9)3-6-4(7)2-5/h2-3,5H2,1H3,(H,6,7)(H,8,9)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.00E+4 -6.27 8.60E+4n/an/an/an/a7.030



Wroclaw University of Technology



Assay Description
Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...


J Med Chem 51: 5736-44 (2008)


Article DOI: 10.1021/jm800570q
BindingDB Entry DOI: 10.7270/Q2PR7T91
More data for this
Ligand-Target Pair