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Target
Histone-arginine methyltransferase CARM1
Ligand
BDBM440472
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:
BDBM440472
Synonyms:
US10633389, Example 138-3 | US20230279020, Example 138-3
Type:
Small organic molecule
Emp. Form.:
C30H39ClN6O3
Mol. Mass.:
567.122
SMILES:
CNC[C@@H](O)COc1ccc(Cl)c(c1)-c1nc(N2CCC3(CCN(C3)C3CC3)C2)c(C)c(n1)-c1c(C)noc1C |r,wD:3.3,(-11.81,1.67,;-10.47,.9,;-9.14,1.67,;-7.81,.9,;-7.81,-.64,;-6.47,1.67,;-5.14,.9,;-3.81,1.67,;-3.81,3.21,;-2.47,3.98,;-1.14,3.21,;.19,3.98,;-1.14,1.67,;-2.47,.9,;.19,.9,;1.53,1.67,;2.86,.9,;4.2,1.67,;4.2,3.21,;5.66,3.69,;6.57,2.44,;7.47,1.2,;8.93,1.67,;8.93,3.21,;7.47,3.69,;10.27,3.98,;11.81,3.98,;11.04,5.32,;5.66,1.2,;2.86,-.64,;4.2,-1.41,;1.53,-1.41,;.19,-.64,;1.53,-2.95,;2.77,-3.85,;4.11,-3.08,;2.3,-5.32,;.76,-5.32,;.28,-3.85,;-1.05,-3.08,)|
Structure:
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