Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetMacrophage metalloelastase
LigandBDBM153385
Substrate/Competitorn/a
Meas. Tech.MMP12 Inhibition Assay
pH8±n/a
Temperature298.15±n/a K
IC50 4.21e+4±n/a nM
Commentsextracted
Citation Rane, RANaphade, SSBangalore, PKPalkar, MBPatel, HMShaikh, MSAlwan, WSKarpoormath, R Synthesis of Novel Hybrids Inspired from Bromopyrrole Alkaloids Inhibiting MMP-2 and -12 as Antineoplastic Agents. Chem Biol Drug Des86:210-22 (2015) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Macrophage metalloelastase
Name:Macrophage metalloelastase
Synonyms:HME | MMP12 | MMP12_HUMAN | Matrix metalloproteinase 12 | Matrix metalloproteinase-12 (MMP 12) | Matrix metalloproteinase-12 (MMP-12) | Matrix metalloproteinase-12 (MMP12) | Matrix metalloproteinases 12 (MMP-12)
Type:Enzyme
Mol. Mass.:54012.99
Organism:Homo sapiens (Human)
Description:P39900
Residue:470
Sequence:
MKFLLILLLQATASGALPLNSSTSLEKNNVLFGERYLEKFYGLEINKLPVTKMKYSGNLM
KEKIQEMQHFLGLKVTGQLDTSTLEMMHAPRCGVPDVHHFREMPGGPVWRKHYITYRINN
YTPDMNREDVDYAIRKAFQVWSNVTPLKFSKINTGMADILVVFARGAHGDFHAFDGKGGI
LAHAFGPGSGIGGDAHFDEDEFWTTHSGGTNLFLTAVHEIGHSLGLGHSSDPKAVMFPTY
KYVDINTFRLSADDIRGIQSLYGDPKENQRLPNPDNSEPALCDPNLSFDAVTTVGNKIFF
FKDRFFWLKVSERPKTSVNLISSLWPTLPSGIEAAYEIEARNQVFLFKDDKYWLISNLRP
EPNYPKSIHSFGFPNFVKKIDAAVFNPRFYRTYFFVDNQYWRYDERRQMMDPGYPKLITK
NFQGIGPKIDAVFYSKNKYYYFFQGSNQFEYDFLLQRITKTLKSNSWFGC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM153385
n/a
NameBDBM153385
Synonyms:2-(4,5-Dibromo-1H-pyrrole-2-carbonyl)-N-(4-nitrophenyl)hydrazine carbothioamide (5c)
TypeSmall organic molecule
Emp. Form.C12H9Br2N5O3S
Mol. Mass.463.105
SMILES[O-][N+](=O)c1ccc(NC(=S)NNC(=O)c2cc(Br)c(Br)[nH]2)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: