Reaction Details
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Matrix metalloproteinase-9
Ligand
BDBM50478728
Substrate
n/a
Meas. Tech.
ChEMBL_556816 (CHEMBL961514)
IC50
67000±n/a nM
Citation
Uto, Y; Nagasawa, H; Jin, CZ; Nakayama, S; Tanaka, A; Kiyoi, S; Nakashima, H; Shimamura, M; Inayama, S; Fujiwara, T; Takeuchi, Y; Uehara, Y; Kirk, KL; Nakata, E; Hori, H Design of antiangiogenic hypoxic cell radiosensitizers: 2-nitroimidazoles containing a 2-aminomethylene-4-cyclopentene-1,3-dione moiety. Bioorg Med Chem 16:6042-53 (2008) [PubMed] Article More Info.:
Target
Name:
Matrix metalloproteinase-9
Synonyms:
3.4.24.35 | 92 kDa gelatinase | 92 kDa type IV collagenase | GELB | Gelatinase B | MMP-9 | MMP9 | MMP9_BOVIN | Matrix metalloproteinase-9
Type:
PROTEIN
Mol. Mass.:
79079.22
Organism:
Bos taurus
Description:
ChEMBL_101350
Residue:
712
Sequence:
MSPLQPLVLALLVLACCSAVPRRRQPTVVVFPGEPRTNLTNRQLAEEYLYRYGYTPGAELSEDGQSLQRALLRFQRRLSLPETGELDSTTLNAMRAPRCGVPDVGRFQTFEGELKWHHHNITYWIQNYSEDLPRAVIDDAFARAFALWSAVTPLTFTRVYGPEADIVIQFGVREHGDGYPFDGKNGLLAHAFPPGKGIQGDAHFDDEELWSLGKGVVIPTYFGNAKGAACHFPFTFEGRSYSACTTDGRSDDMLWCSTTADYDADRQFGFCPSERLYTQDGNADGKPCVFPFTFQGRTYSACTSDGRSDGYRWCATTANYDQDKLYGFCPTRVDATVTGGNAAGELCVFPFTFLGKEYSACTREGRNDGHLWCATTSNFDKDKKWGFCPDQGYSLFLVAAHEFGHALGLDHTSVPEALMYPMYRFTEEHPLHRDDVQGIQHLYGPRPEPEPRPPTTTTTTTTEPQPTAPPTVCVTGPPTARPSEGPTTGPTGPPAAGPTGPPTAGPSAAPTESPDPAEDVCNVDIFDAIAEIRNRLHFFKAGKYWRLSEGGGRRVQGPFLVKSKWPALPRKLDSAFEDPLTKKIFFFSGRQVWVYTGASLLGPRRLDKLGLGPEVAQVTGALPRPEGKVLLFSGQSFWRFDVKTQKVDPQSVTPVDQMFPGVPISTHDIFQYQEKAYFCQDHFYWRVSSQNEVNQVDYVGYVTFDLLKCPED
Inhibitor
Name:
BDBM50478728
Synonyms:
CHEMBL490266 | TX-2036
Type:
Small organic molecule
Emp. Form.:
C29H28N4O7
Mol. Mass.:
544.5552
SMILES:
[#6]C([#6])([#6])c1ccc(-[#8]-[#6]-[#6@@H](-[#6]-n2ccnc2-[#7+](-[#8-])=O)-[#8]-[#6](=O)-c2ccc(-[#7]\[#6]=[#6]-3/[#6](=O)-[#6]=[#6]-[#6]-3=O)cc2)cc1 |r,c:33|
Structure:
