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Target
Histone-arginine methyltransferase CARM1
Ligand
BDBM440524
Substrate
n/a
Meas. Tech.
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  US10633389 Publication Date 4/28/2020 
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:
BDBM440524
Synonyms:
US10633389, Example 190-3 | US20230279020, Example 190-3
Type:
Small organic molecule
Emp. Form.:
C26H28ClN7O3
Mol. Mass.:
521.999
SMILES:
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2Cc3cncnc3C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-10.38,1.9,;-9.04,1.13,;-7.71,1.9,;-6.37,1.13,;-6.37,-.41,;-5.04,1.9,;-3.71,1.13,;-2.37,1.9,;-2.37,3.44,;-1.04,4.21,;.29,3.44,;1.63,4.21,;.29,1.9,;-1.04,1.13,;1.63,1.13,;2.96,1.9,;4.29,1.13,;5.63,1.9,;7.04,1.28,;8.07,2.42,;9.61,2.42,;10.38,3.75,;9.61,5.09,;8.07,5.09,;7.3,3.75,;5.79,3.43,;4.29,-.41,;5.63,-1.18,;2.96,-1.18,;1.63,-.41,;2.96,-2.72,;4.21,-3.62,;5.69,-3.22,;3.73,-5.09,;2.19,-5.09,;1.72,-3.62,;.23,-3.22,)|
Structure:
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