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Target
Protein arginine N-methyltransferase 1
Ligand
BDBM502131
Substrate
n/a
Meas. Tech.
PRMT1 Enzymatic Assay
IC50
34.0±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:
BDBM502131
Synonyms:
US11028083, Example 96b
Type:
Small organic molecule
Emp. Form.:
C22H38N4O
Mol. Mass.:
374.5633
SMILES:
CNCCN(C)Cc1nn2CCCc2c1[C@H]1CC[C@@]2(CC(C)(C)CO2)CC1 |r,wU:18.26,wD:15.16,(4.05,-5.18,;5.38,-4.41,;5.38,-2.87,;4.05,-2.1,;4.05,-.56,;5.38,.21,;2.71,.21,;1.38,-.56,;1.93,-1.99,;.73,-2.96,;.34,-4.45,;-1.2,-4.53,;-1.75,-3.09,;-.56,-2.12,;-.16,-.64,;-1.49,.13,;-1.49,1.67,;-2.83,2.44,;-4.16,1.67,;-4.16,3.21,;-5.62,3.69,;-5.23,5.18,;-6.71,4.78,;-6.53,2.44,;-5.62,1.2,;-4.16,.13,;-2.83,-.64,)|
Structure:
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