Reaction Details Report a problem with these data
Target
NACHT, LRR and PYD domains-containing protein 3
Ligand
BDBM76299
Substrate
n/a
Meas. Tech.
Dose Response confirmation of uHTS for the identification of inhibitors of NALP3 in yeast using a luminescent assay
IC50
4790±n/a nM
Citation
 PubChem, PC Dose Response confirmation of uHTS for the identification of inhibitors of NALP3 in yeast using a luminescent assay PubChem Bioassay (2010)[AID] 
Target
Name:
NACHT, LRR and PYD domains-containing protein 3
Synonyms:
C1orf7 | CIAS1 | NALP3 | NLRP3 | NLRP3 protein | NLRP3_HUMAN | PYPAF1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
118173.88
Organism:
Homo sapiens (Human)
Description:
Q96P20
Residue:
1036
Sequence:
MKMASTRCKLARYLEDLEDVDLKKFKMHLEDYPPQKGCIPLPRGQTEKADHVDLATLMIDFNGEEKAWAMAVWIFAAINRRDLYEKAKRDEPKWGSDNARVSNPTVICQEDSIEEEWMGLLEYLSRISICKMKKDYRKKYRKYVRSRFQCIEDRNARLGESVSLNKRYTRLRLIKEHRSQQEREQELLAIGKTKTCESPVSPIKMELLFDPDDEHSEPVHTVVFQGAAGIGKTILARKMMLDWASGTLYQDRFDYLFYIHCREVSLVTQRSLGDLIMSCCPDPNPPIHKIVRKPSRILFLMDGFDELQGAFDEHIGPLCTDWQKAERGDILLSSLIRKKLLPEASLLITTRPVALEKLQHLLDHPRHVEILGFSEAKRKEYFFKYFSDEAQARAAFSLIQENEVLFTMCFIPLVCWIVCTGLKQQMESGKSLAQTSKTTTAVYVFFLSSLLQPRGGSQEHGLCAHLWGLCSLAADGIWNQKILFEESDLRNHGLQKADVSAFLRMNLFQKEVDCEKFYSFIHMTFQEFFAAMYYLLEEEKEGRTNVPGSRLKLPSRDVTVLLENYGKFEKGYLIFVVRFLFGLVNQERTSYLEKKLSCKISQQIRLELLKWIEVKAKAKKLQIQPSQLELFYCLYEMQEEDFVQRAMDYFPKIEINLSTRMDHMVSSFCIENCHRVESLSLGFLHNMPKEEEEEEKEGRHLDMVQCVLPSSSHAACSHGLVNSHLTSSFCRGLFSVLSTSQSLTELDLSDNSLGDPGMRVLCETLQHPGCNIRRLWLGRCGLSHECCFDISLVLSSNQKLVELDLSDNALGDFGIRLLCVGLKHLLCNLKKLWLVSCCLTSACCQDLASVLSTSHSLTRLYVGENALGDSGVAILCEKAKNPQCNLQKLGLVNSGLTSVCCSALSSVLSTNQNLTHLYLRGNTLGDKGIKLLCEGLLHPDCKLQVLELDNCNLTSHCCWDLSTLLTSSQSLRKLSLGNNDLGDLGVMMFCEVLKQQSCLLQNLGLSEMYFNYETKSALETLQEEKPELTVVFEPSW
  
Inhibitor
Name:
BDBM76299
Synonyms:
(8-amino-10-phenyl-phenazin-10-ium-2-yl)-diethyl-amine;chloride | 2-N,2-N-diethyl-10-phenylphenazin-10-ium-2,8-diamine;chloride | MLS001359835 | Methylene Violet 3RAX | N2,N2-diethyl-10-phenyl-phenazin-10-ium-2,8-diamine;chloride | N2,N2-diethyl-10-phenylphenazin-10-ium-2,8-diamine;chloride | SMR001224409 | cid_2733867
Type:
Small organic molecule
Emp. Form.:
C22H23N4
Mol. Mass.:
343.4443
SMILES:
CC[N+](CC)=c1ccc2nc3ccc(N)cc3n(-c3ccccc3)c2c1 |(14.37,8.04,;13.04,7.27,;11.7,8.03,;11.7,9.57,;13.03,10.35,;10.37,7.26,;10.37,5.65,;8.98,4.86,;7.6,5.68,;6.26,4.91,;4.93,5.68,;3.55,4.86,;2.16,5.65,;2.16,7.26,;.83,8.03,;3.55,8.05,;4.93,7.22,;6.26,7.99,;6.26,9.53,;7.6,10.3,;7.6,11.84,;6.26,12.61,;4.93,11.84,;4.93,10.3,;7.6,7.22,;8.98,8.05,)|
Structure:
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