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Target
Protein arginine N-methyltransferase 1
Ligand
BDBM502116
Substrate
n/a
Meas. Tech.
PRMT1 Enzymatic Assay
IC50
24.0±n/a nM
Citation
 Di Francesco, ME; Jones, P; McAfoos, TJ Ethanediamine-heterocycle derivatives as inhibitors of protein arginine methyltransferases US Patent  US11028083 Publication Date 6/8/2021 
Target
Name:
Protein arginine N-methyltransferase 1
Synonyms:
2.1.1.319 | ANM1_HUMAN | HMT2 | HRMT1L2 | HRMT1L2 {ECO:0000303|PubMed:11097842 | Histone-arginine N-methyltransferase PRMT1 | IR1B4 | Interferon receptor 1-bound protein 4 | PRMT1 | Protein arginine N-methyltransferase 1 | Protein-arginine N-methyltransferase 1 | Synonyms=HMT2
Type:
PROTEIN
Mol. Mass.:
42451.61
Organism:
Homo sapiens
Description:
ChEMBL_100878
Residue:
371
Sequence:
MAAAEAANCIMENFVATLANGMSLQPPLEEVSCGQAESSEKPNAEDMTSKDYYFDSYAHFGIHEEMLKDEVRTLTYRNSMFHNRHLFKDKVVLDVGSGTGILCMFAAKAGARKVIGIECSSISDYAVKIVKANKLDHVVTIIKGKVEEVELPVEKVDIIISEWMGYCLFYESMLNTVLYARDKWLAPDGLIFPDRATLYVTAIEDRQYKDYKIHWWENVYGFDMSCIKDVAIKEPLVDVVDPKQLVTNACLIKEVDIYTVKVEDLTFTSPFCLQVKRNDYVHALVAYFNIEFTRCHKRTGFSTSPESPYTHWKQTVFYMEDYLTVKTGEEIFGTIGMRPNAKNNRDLDFTIDLDFKGQLCELSCSTDYRMR
  
Inhibitor
Name:
BDBM502116
Synonyms:
US11028083, Example 87b
Type:
Small organic molecule
Emp. Form.:
C23H38F2N4O
Mol. Mass.:
424.5708
SMILES:
CNCCN(C)Cc1nn2CC(F)(F)Cc2c1[C@H]1CC[C@@]2(CC1)COCC(C)(C)C2 |r,wD:20.22,17.18,(8.1,7.56,;6.77,8.33,;5.44,7.56,;4.1,8.33,;2.77,7.56,;2.77,6.02,;1.44,8.33,;.1,7.56,;.65,6.12,;-.54,5.15,;-.94,3.66,;-2.48,3.58,;-2.48,2.04,;-3.81,2.81,;-3.03,5.02,;-1.83,5.99,;-1.44,7.48,;-2.77,8.25,;-2.77,9.79,;-4.1,10.56,;-5.44,9.79,;-5.44,8.25,;-4.1,7.48,;-6.77,9.02,;-8.1,9.79,;-8.1,11.33,;-6.77,12.1,;-7.54,13.43,;-6,13.43,;-5.44,11.33,)|
Structure:
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