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Target
Histone-arginine methyltransferase CARM1
Ligand
BDBM440519
Substrate
n/a
Meas. Tech.
CARM1 Enzyme Assay
IC50
<100±n/a nM
Citation
 Chesworth, R; Moradei, OM; Shapiro, G; Jin, L; Babine, RE CARM1 INHIBITORS AND USES THEREOF US Patent  US20230279020 Publication Date 9/7/2023 
Target
Name:
Histone-arginine methyltransferase CARM1
Synonyms:
CARM1 | CARM1_HUMAN | Coactivator-associated arginine methyltransferase 1 | Coactivator-associated arginine methyltransferase 1 (CARM1) | PRMT4 | Protein arginine N-methyltransferase 4 | Protein arginine methyltransferase 4 (PRMT4)
Type:
Protein
Mol. Mass.:
65855.47
Organism:
Homo sapiens (Human)
Description:
Q86X55
Residue:
608
Sequence:
MAAAAAAVGPGAGGAGSAVPGGAGPCATVSVFPGARLLTIGDANGEIQRHAEQQALRLEVRAGPDSAGIALYSHEDVCVFKCSVSRETECSRVGKQSFIITLGCNSVLIQFATPNDFCSFYNILKTCRGHTLERSVFSERTEESSAVQYFQFYGYLSQQQNMMQDYVRTGTYQRAILQNHTDFKDKIVLDVGCGSGILSFFAAQAGARKIYAVEASTMAQHAEVLVKSNNLTDRIVVIPGKVEEVSLPEQVDIIISEPMGYMLFNERMLESYLHAKKYLKPSGNMFPTIGDVHLAPFTDEQLYMEQFTKANFWYQPSFHGVDLSALRGAAVDEYFRQPVVDTFDIRILMAKSVKYTVNFLEAKEGDLHRIEIPFKFHMLHSGLVHGLAFWFDVAFIGSIMTVWLSTAPTEPLTHWYQVRCLFQSPLFAKAGDTLSGTCLLIANKRQSYDISIVAQVDQTGSKSSNLLDLKNPFFRYTGTTPSPPPGSHYTSPSENMWNTGSTYNLSSGMAVAGMPTAYDLSSVIASGSSVGHNNLIPLANTGIVNHTHSRMGSIMSTGIVQGSSGAQGSGGGSTSAHYAVNSQFTMGGPAISMASPMSIPTNTMHYGS
  
Inhibitor
Name:
BDBM440519
Synonyms:
US10633389, Example 185-3 | US20230279020, Example 185-3
Type:
Small organic molecule
Emp. Form.:
C27H28ClFN6O3
Mol. Mass.:
539.001
SMILES:
CNC[C@@H](O)COc1ccc(F)c(c1)-c1nc(N2Cc3cc(Cl)cnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.15,1.9,;-9.81,1.13,;-8.48,1.9,;-7.14,1.13,;-7.14,-.41,;-5.81,1.9,;-4.48,1.13,;-3.14,1.9,;-3.14,3.44,;-1.81,4.21,;-.48,3.44,;.86,4.21,;-.48,1.9,;-1.81,1.13,;.86,1.13,;2.19,1.9,;3.52,1.13,;4.86,1.9,;6.27,1.28,;7.3,2.42,;8.84,2.42,;9.61,3.75,;11.15,3.75,;8.84,5.09,;7.3,5.09,;6.53,3.75,;5.02,3.43,;3.52,-.41,;4.86,-1.18,;2.19,-1.18,;.86,-.41,;2.19,-2.72,;3.44,-3.62,;4.92,-3.22,;2.96,-5.09,;1.42,-5.09,;.95,-3.62,;-.54,-3.22,)|
Structure:
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