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Target
Mitogen-activated protein kinase kinase kinase 2
Ligand
BDBM50505859
Substrate
n/a
Meas. Tech.
ChEMBL_1824426 (CHEMBL4324190)
IC50
910±n/a nM
Citation
 Röhm, S; Berger, BT; Schröder, M; Chaikuad, A; Winkel, R; Hekking, KFW; Benningshof, JJC; Müller, G; Tesch, R; Kudolo, M; Forster, M; Laufer, S; Knapp, S Fast Iterative Synthetic Approach toward Identification of Novel Highly Selective p38 MAP Kinase Inhibitors. J Med Chem 62:10757-10782 (2019) [PubMed]  Article 
Target
Name:
Mitogen-activated protein kinase kinase kinase 2
Synonyms:
M3K2_HUMAN | MAP3K2 | MAPK/ERK kinase kinase 2 | MAPKKK2 | MEK kinase 2 | MEKK 2 | MEKK2
Type:
PROTEIN
Mol. Mass.:
69751.14
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1473904
Residue:
619
Sequence:
MDDQQALNSIMQDLAVLHKASRPALSLQETRKAKSSSPKKQNDVRVKFEHRGEKRILQFPRPVKLEDLRSKAKIAFGQSMDLHYTNNELVIPLTTQDDLDKAVELLDRSIHMKSLKILLVINGSTQATNLEPLPSLEDLDNTVFGAERKKRLSIIGPTSRDRSSPPPGYIPDELHQVARNGSFTSINSEGEFIPESMDQMLDPLSLSSPENSGSGSCPSLDSPLDGESYPKSRMPRAQSYPDNHQEFSDYDNPIFEKFGKGGTYPRRYHVSYHHQEYNDGRKTFPRARRTQGTSLRSPVSFSPTDHSLSTSSGSSIFTPEYDDSRIRRRGSDIDNPTLTVMDISPPSRSPRAPTNWRLGKLLGQGAFGRVYLCYDVDTGRELAVKQVQFDPDSPETSKEVNALECEIQLLKNLLHERIVQYYGCLRDPQEKTLSIFMEYMPGGSIKDQLKAYGALTENVTRKYTRQILEGVHYLHSNMIVHRDIKGANILRDSTGNVKLGDFGASKRLQTICLSGTGMKSVTGTPYWMSPEVISGEGYGRKADIWSVACTVVEMLTEKPPWAEFEAMAAIFKIATQPTNPKLPPHVSDYTRDFLKRIFVEAKLRPSADELLRHMFVHYH
  
Inhibitor
Name:
BDBM50505859
Synonyms:
CHEMBL4436748
Type:
Small organic molecule
Emp. Form.:
C27H33N5O2
Mol. Mass.:
459.5832
SMILES:
Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)NCCCC1CCCCC1
Structure:
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