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Target
Protein arginine N-methyltransferase 1
Ligand
BDBM502107
Substrate
n/a
Meas. Tech.
PRMT1 Enzymatic Assay
IC50
70.0±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:
BDBM502107
Synonyms:
US11028083, Example 82a | US11028083, Example 82b
Type:
Small organic molecule
Emp. Form.:
C22H37F3N4O2
Mol. Mass.:
446.55
SMILES:
CC[C@]1(COCC(F)(F)F)CC[C@@H](CC1)c1c(CN(C)CCNC)nn2CCOCc12 |r,wU:12.15,2.1,wD:2.2,(-7.44,10.02,;-7.44,11.56,;-6.1,12.33,;-6.1,13.87,;-4.77,14.64,;-3.44,13.87,;-2.1,14.64,;-.77,15.41,;-1.33,13.3,;-2.87,15.97,;-6.1,10.79,;-4.77,10.02,;-3.44,10.79,;-3.44,12.33,;-4.77,13.1,;-2.1,10.02,;-.56,10.1,;.77,10.87,;2.1,10.1,;2.1,8.56,;3.44,10.87,;4.77,10.1,;6.1,10.87,;7.44,10.1,;-.01,8.66,;-1.21,7.69,;-1.29,6.15,;-2.66,5.45,;-3.95,6.29,;-3.87,7.83,;-2.5,8.53,)|
Structure:
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