| Reaction Details |
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 | Report a problem with these data |
| Target | Inhibitor of nuclear factor kappa-B kinase subunit epsilon |
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| Ligand | BDBM245950 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Time-Resolved Fluorescence-based Lanthascreen Assay |
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| pH | 7.5±n/a |
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| IC50 | <15±n/a nM |
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| Comments | extracted |
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| Citation |  Newton, GK; Stewart, MR; Perrior, TR; Crosby, SR; Hopkins, A; Negoita-Giras, G; Jenkins, K Pyrimidine compounds useful in the treatment of diseases mediated by IKKE and/or TBK1 mechanisms US Patent US9433622 Publication Date 9/6/2016 |
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| More Info.: | Get all data from this article, Assay Method |
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| Inhibitor of nuclear factor kappa-B kinase subunit epsilon |
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| Name: | Inhibitor of nuclear factor kappa-B kinase subunit epsilon |
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| Synonyms: | I kappa-B kinase epsilon | I-kappa-B Kinase 3 (IKK-epsilon) | I-kappa-B kinase epsilon (IKK-E) | I-kappa-B kinase epsilon (IKKE) | IKBKE | IKK-E | IKK-epsilon | IKK-i | IKKE | IKKE_HUMAN | IKKI | Inducible I kappa-B kinase | KIAA0151 | von Hippel-Lindau disease tumor suppressor/Inhibitor of nuclear factor kappa-B kinase subunit epsilon |
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| Type: | Serine/threonine-protein kinase |
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| Mol. Mass.: | 80475.98 |
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| Organism: | Homo sapiens (Human) |
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| Description: | Kinase inhibitory activity was determined using recombinant human IKK-epsilon expressed in baculovirus as a FLAG-tagged fusion protein. |
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| Residue: | 716 |
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| Sequence: | MQSTANYLWHTDDLLGQGATASVYKARNKKSGELVAVKVFNTTSYLRPREVQVREFEVLR
KLNHQNIVKLFAVEETGGSRQKVLVMEYCSSGSLLSVLESPENAFGLPEDEFLVVLRCVV
AGMNHLRENGIVHRDIKPGNIMRLVGEEGQSIYKLTDFGAARELDDDEKFVSVYGTEEYL
HPDMYERAVLRKPQQKAFGVTVDLWSIGVTLYHAATGSLPFIPFGGPRRNKEIMYRITTE
KPAGAIAGAQRRENGPLEWSYTLPITCQLSLGLQSQLVPILANILEVEQAKCWGFDQFFA
ETSDILQRVVVHVFSLSQAVLHHIYIHAHNTIAIFQEAVHKQTSVAPRHQEYLFEGHLCV
LEPSVSAQHIAHTTASSPLTLFSTAIPKGLAFRDPALDVPKFVPKVDLQADYNTAKGVLG
AGYQALRLARALLDGQELMFRGLHWVMEVLQATCRRTLEVARTSLLYLSSSLGTERFSSV
AGTPEIQELKAAAELRSRLRTLAEVLSRCSQNITETQESLSSLNRELVKSRDQVHEDRSI
QQIQCCLDKMNFIYKQFKKSRMRPGLGYNEEQIHKLDKVNFSHLAKRLLQVFQEECVQKY
QASLVTHGKRMRVVHETRNHLRLVGCSVAACNTEAQGVQESLSKLLEELSHQLLQDRAKG
AQASPPPIAPYPSPTRKDLLLHMQELCEGMKLLASDLLDNNRIIERLNRVPAPPDV
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| BDBM245950 |
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| n/a |
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| Name | BDBM245950 |
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| Synonyms: | US9433622, DMX- 22 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H25FN8O |
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| Mol. Mass. | 448.496 |
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| SMILES | CC(C)(O)CNc1ccc(Nc2nccc(n2)-c2cnc(N3CC[C@H](F)C3)c(c2)C#N)cn1 |r| |
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| Structure | 
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