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Target
Disintegrin and metalloproteinase domain-containing protein 10
Ligand
BDBM42818
Substrate
n/a
Meas. Tech.
QFRET-based biochemical high throughput dose response assay to identify exosite inhibitors of ADAM10.
IC50
69513±n/a nM
Citation
 PubChem, PC QFRET-based biochemical high throughput dose response assay to identify exosite inhibitors of ADAM10. PubChem Bioassay (2014)[AID] 
Target
Name:
Disintegrin and metalloproteinase domain-containing protein 10
Synonyms:
ADA10_HUMAN | ADAM10 | Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10) | KUZ | MADM
Type:
Enzyme
Mol. Mass.:
84160.93
Organism:
Homo sapiens (Human)
Description:
O14672
Residue:
748
Sequence:
MVLLRVLILLLSWAAGMGGQYGNPLNKYIRHYEGLSYNVDSLHQKHQRAKRAVSHEDQFLRLDFHAHGRHFNLRMKRDTSLFSDEFKVETSNKVLDYDTSHIYTGHIYGEEGSFSHGSVIDGRFEGFIQTRGGTFYVEPAERYIKDRTLPFHSVIYHEDDINYPHKYGPQGGCADHSVFERMRKYQMTGVEEVTQIPQEEHAANGPELLRKKRTTSAEKNTCQLYIQTDHLFFKYYGTREAVIAQISSHVKAIDTIYQTTDFSGIRNISFMVKRIRINTTADEKDPTNPFRFPNIGVEKFLELNSEQNHDDYCLAYVFTDRDFDDGVLGLAWVGAPSGSSGGICEKSKLYSDGKKKSLNTGIITVQNYGSHVPPKVSHITFAHEVGHNFGSPHDSGTECTPGESKNLGQKENGNYIMYARATSGDKLNNNKFSLCSIRNISQVLEKKRNNCFVESGQPICGNGMVEQGEECDCGYSDQCKDECCFDANQPEGRKCKLKPGKQCSPSQGPCCTAQCAFKSKSEKCRDDSDCAREGICNGFTALCPASDPKPNFTDCNRHTQVCINGQCAGSICEKYGLEECTCASSDGKDDKELCHVCCMKKMDPSTCASTGSVQWSRHFSGRTITLQPGSPCNDFRGYCDVFMRCRLVDADGPLARLKKAIFSPELYENIAEWIVAHWWAVLLMGIALIMLMAGFIKICSVHTPSSNPKLPPPKPLPGTLKRRRPPQPIQQPQRQRPRESYQMGHMRR
  
Inhibitor
Name:
BDBM42818
Synonyms:
3-({4-[(4-phenyl-1-piperazinyl)carbonyl]cyclohexyl}methyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone | 3-[[4-(4-phenylpiperazin-1-yl)carbonylcyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one | 3-[[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one | 3-[[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl]-2-thioxo-1H-quinazolin-4-one | 3-[[4-[oxo-(4-phenyl-1-piperazinyl)methyl]cyclohexyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one | MLS000097399 | SMR000076048 | cid_2952511
Type:
Small organic molecule
Emp. Form.:
C26H30N4O2S
Mol. Mass.:
462.607
SMILES:
O=C(C1CCC(Cn2c(=S)[nH]c3ccccc3c2=O)CC1)N1CCN(CC1)c1ccccc1 |(11.08,3.47,;11.08,1.93,;12.42,1.16,;13.75,1.93,;15.08,1.16,;15.08,-.39,;16.42,-1.16,;17.75,-.39,;17.75,1.16,;16.42,1.93,;19.08,1.93,;20.42,1.16,;21.8,1.98,;23.19,1.19,;23.19,-.42,;21.8,-1.21,;20.42,-.39,;19.08,-1.16,;19.08,-2.7,;13.75,-1.16,;12.42,-.39,;9.75,1.16,;8.41,1.93,;7.08,1.16,;7.08,-.39,;8.41,-1.16,;9.75,-.39,;5.75,-1.16,;4.41,-.39,;3.08,-1.16,;3.08,-2.7,;4.41,-3.47,;5.75,-2.7,)|
Structure:
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