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Target
Protein arginine N-methyltransferase 1
Ligand
BDBM502003
Substrate
n/a
Meas. Tech.
PRMT1 Enzymatic Assay
IC50
58.0±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:
BDBM502003
Synonyms:
US11028083, Example 1b
Type:
Small organic molecule
Emp. Form.:
C22H40N4O
Mol. Mass.:
376.5792
SMILES:
CCOC[C@]1(CC)CC[C@@H](CC1)c1c(CN(C)CCNC)nn2CCCc12 |r,wU:4.3,9.12,wD:4.4,(-1.44,13.14,;-2.77,12.37,;-4.1,13.14,;-5.44,12.37,;-5.44,10.83,;-6.77,10.06,;-8.1,10.83,;-5.44,9.29,;-4.1,8.52,;-2.77,9.29,;-2.77,10.83,;-4.1,11.6,;-1.44,8.52,;.1,8.6,;1.44,9.37,;2.77,8.6,;2.77,7.06,;4.1,9.37,;5.44,8.6,;6.77,9.37,;8.1,8.6,;.65,7.16,;-.54,6.19,;-.94,4.7,;-2.48,4.62,;-3.03,6.06,;-1.83,7.03,)|
Structure:
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