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Target
Tyrosine-protein kinase JAK1
Ligand
BDBM277379
Substrate
n/a
Meas. Tech.
Jak Biochemical HTRF Assay Protocol
Temperature
298.15±n/a K
IC50
2.88±n/a nM
Comments
extracted
Citation
 Scott, ME; Guerin, D; Molinari, D; Kattar, S; Fuller, P; Dinsmore, C; Kong, N; Bai, Y; Fu, J; Liu, Y; Zheng, Z Ethyl N-boc piperidinyl pyrazolo pyridones as Janus kinase inhibitors US Patent  US10072025 Publication Date 9/11/2018 
Target
Name:
Tyrosine-protein kinase JAK1
Synonyms:
JAK-1 | JAK1 | JAK1A | JAK1B | JAK1_HUMAN | Janus kinase 1 | Janus kinase 1 (JAK1) | Janus kinase 1 JAK1
Type:
Protein
Mol. Mass.:
133293.73
Organism:
Homo sapiens (Human)
Description:
P23458
Residue:
1154
Sequence:
MQYLNIKEDCNAMAFCAKMRSSKKTEVNLEAPEPGVEVIFYLSDREPLRLGSGEYTAEELCIRAAQACRISPLCHNLFALYDENTKLWYAPNRTITVDDKMSLRLHYRMRFYFTNWHGTNDNEQSVWRHSPKKQKNGYEKKKIPDATPLLDASSLEYLFAQGQYDLVKCLAPIRDPKTEQDGHDIENECLGMAVLAISHYAMMKKMQLPELPKDISYKRYIPETLNKSIRQRNLLTRMRINNVFKDFLKEFNNKTICDSSVSTHDLKVKYLATLETLTKHYGAEIFETSMLLISSENEMNWFHSNDGGNVLYYEVMVTGNLGIQWRHKPNVVSVEKEKNKLKRKKLENKHKKDEEKNKIREEWNNFSYFPEITHIVIKESVVSINKQDNKKMELKLSSHEEALSFVSLVDGYFRLTADAHHYLCTDVAPPLIVHNIQNGCHGPICTEYAINKLRQEGSEEGMYVLRWSCTDFDNILMTVTCFEKSEQVQGAQKQFKNFQIEVQKGRYSLHGSDRSFPSLGDLMSHLKKQILRTDNISFMLKRCCQPKPREISNLLVATKKAQEWQPVYPMSQLSFDRILKKDLVQGEHLGRGTRTHIYSGTLMDYKDDEGTSEEKKIKVILKVLDPSHRDISLAFFEAASMMRQVSHKHIVYLYGVCVRDVENIMVEEFVEGGPLDLFMHRKSDVLTTPWKFKVAKQLASALSYLEDKDLVHGNVCTKNLLLAREGIDSECGPFIKLSDPGIPITVLSRQECIERIPWIAPECVEDSKNLSVAADKWSFGTTLWEICYNGEIPLKDKTLIEKERFYESRCRPVTPSCKELADLMTRCMNYDPNQRPFFRAIMRDINKLEEQNPDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTGEQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGIKLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHRDLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPECLMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVTRLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEALLK
  
Inhibitor
Name:
BDBM277379
Synonyms:
US10072025, Example 3-13 | US10072025, Example 3-14 | US10072025, Example 3-15 | US10072025, Example 3-16 | tert-butyl 4-[3-({4-[(2,3- dimethylmorpholin-4- yl)carbonyl]-3- methylphenyl}amino)-4- oxo-4,5-dihydro-1H- pyrazolo[4,3-c] pyridin-1- yl]-4-ethylpiperidine-1- carboxylate (Peak 2, separated by mass triggered reverse phase HPLC (ACN/water with 0.1% NH4OH modifier) then was separated by SFC using Phenomenex Lux-4 column, eluting with 40% methanol +0.25% dimethyl ethyl amine in CO2, retention time peak B: 10.2 minutes.)
Type:
Small organic molecule
Emp. Form.:
C32H44N6O5
Mol. Mass.:
592.729
SMILES:
CCC1(CCN(CC1)C(=O)OC(C)(C)C)n1nc(Nc2ccc(C(=O)N3CCOC(C)C3C)c(C)c2)c2c1cc[nH]c2=O
Structure:
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