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Target
Tyrosine-protein kinase JAK2
Ligand
BDBM50399018
Substrate
n/a
Meas. Tech.
ChEMBL_874070 (CHEMBL2186603)
IC50
242±n/a nM
Citation
 Hanan, EJ; van Abbema, A; Barrett, K; Blair, WS; Blaney, J; Chang, C; Eigenbrot, C; Flynn, S; Gibbons, P; Hurley, CA; Kenny, JR; Kulagowski, J; Lee, L; Magnuson, SR; Morris, C; Murray, J; Pastor, RM; Rawson, T; Siu, M; Ultsch, M; Zhou, A; Sampath, D; Lyssikatos, JP Discovery of potent and selective pyrazolopyrimidine janus kinase 2 inhibitors. J Med Chem 55:10090-107 (2012) [PubMed]  Article 
Target
Name:
Tyrosine-protein kinase JAK2
Synonyms:
JAK-2 | JAK2 | JAK2_HUMAN | Janus kinase 2 | Janus kinase 2 (JAK2) | Janus kinase 2 (a protein tyrosine kinase)
Type:
Protein
Mol. Mass.:
130684.68
Organism:
Homo sapiens (Human)
Description:
O60674
Residue:
1132
Sequence:
MGMACLTMTEMEGTSTSSIYQNGDISGNANSMKQIDPVLQVYLYHSLGKSEADYLTFPSGEYVAEEICIAASKACGITPVYHNMFALMSETERIWYPPNHVFHIDESTRHNVLYRIRFYFPRWYCSGSNRAYRHGISRGAEAPLLDDFVMSYLFAQWRHDFVHGWIKVPVTHETQEECLGMAVLDMMRIAKENDQTPLAIYNSISYKTFLPKCIRAKIQDYHILTRKRIRYRFRRFIQQFSQCKATARNLKLKYLINLETLQSAFYTEKFEVKEPGSGPSGEEIFATIIITGNGGIQWSRGKHKESETLTEQDLQLYCDFPNIIDVSIKQANQEGSNESRVVTIHKQDGKNLEIELSSLREALSFVSLIDGYYRLTADAHHYLCKEVAPPAVLENIQSNCHGPISMDFAISKLKKAGNQTGLYVLRCSPKDFNKYFLTFAVERENVIEYKHCLITKNENEEYNLSGTKKNFSSLKDLLNCYQMETVRSDNIIFQFTKCCPPKPKDKSNLLVFRTNGVSDVPTSPTLQRPTHMNQMVFHKIRNEDLIFNESLGQGTFTKIFKGVRREVGDYGQLHETEVLLKVLDKAHRNYSESFFEAASMMSKLSHKHLVLNYGVCVCGDENILVQEFVKFGSLDTYLKKNKNCINILWKLEVAKQLAWAMHFLEENTLIHGNVCAKNILLIREEDRKTGNPPFIKLSDPGISITVLPKDILQERIPWVPPECIENPKNLNLATDKWSFGTTLWEICSGGDKPLSALDSQRKLQFYEDRHQLPAPKWAELANLINNCMDYEPDFRPSFRAIIRDLNSLFTPDYELLTENDMLPNMRIGALGFSGAFEDRDPTQFEERHLKFLQQLGKGNFGSVEMCRYDPLQDNTGEVVAVKKLQHSTEEHLRDFEREIEILKSLQHDNIVKYKGVCYSAGRRNLKLIMEYLPYGSLRDYLQKHKERIDHIKLLQYTSQICKGMEYLGTKRYIHRDLATRNILVENENRVKIGDFGLTKVLPQDKEYYKVKEPGESPIFWYAPESLTESKFSVASDVWSFGVVLYELFTYIEKSKSPPAEFMRMIGNDKQGQMIVFHLIELLKNNGRLPRPDGCPDEIYMIMTECWNNNVNQRPSFRDLALRVDQIRDNMAG
  
Inhibitor
Name:
BDBM50399018
Synonyms:
CHEMBL2177122
Type:
Small organic molecule
Emp. Form.:
C17H12Cl2N6O
Mol. Mass.:
387.223
SMILES:
Cn1cc(NC(=O)c2cnn3cccnc23)c(n1)-c1c(Cl)cccc1Cl |(4.01,-28.58,;5.47,-28.11,;5.95,-26.65,;7.5,-26.65,;8.41,-25.41,;7.78,-24,;6.25,-23.83,;8.69,-22.76,;8.22,-21.29,;9.46,-20.38,;10.71,-21.29,;12.22,-20.97,;13.26,-22.13,;12.78,-23.6,;11.26,-23.91,;10.23,-22.76,;7.96,-28.12,;6.71,-29.02,;9.43,-28.6,;10.57,-27.58,;10.25,-26.08,;12.03,-28.06,;12.35,-29.57,;11.19,-30.6,;9.73,-30.11,;8.58,-31.14,)|
Structure:
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