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Target
Histone-arginine methyltransferase CARM1
Ligand
BDBM50609340
Substrate
n/a
Meas. Tech.
ChEMBL_2277360
IC50
10±n/a nM
Citation
 Zhang, Z; Guo, Z; Xu, X; Cao, D; Yang, H; Li, Y; Shi, Q; Du, Z; Guo, X; Wang, X; Chen, D; Zhang, Y; Chen, L; Zhou, K; Li, J; Geng, M; Huang, X; Xiong, B Structure-Based Discovery of Potent CARM1 Inhibitors for Solid Tumor and Cancer Immunology Therapy. J Med Chem 64:16650-16674 (2021) [PubMed] 
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:
BDBM50609340
Synonyms:
CHEMBL5289773
Type:
Small organic molecule
Emp. Form.:
C28H32N6O
Mol. Mass.:
468.5933
SMILES:
CNCCNCc1cccc(c1)-c1nc(N2Cc3ccccc3C2)c(C)c(n1)-c1c(C)noc1C |(65.26,-11.76,;66.59,-10.99,;67.93,-11.76,;69.26,-10.99,;70.59,-11.76,;71.93,-10.99,;73.26,-11.76,;73.26,-13.3,;74.59,-14.07,;75.93,-13.3,;75.93,-11.75,;74.59,-10.99,;77.26,-10.98,;77.24,-9.45,;78.57,-8.67,;78.55,-7.13,;79.79,-6.22,;79.31,-4.76,;80.08,-3.42,;79.3,-2.09,;77.75,-2.1,;76.99,-3.44,;77.77,-4.77,;77.3,-6.24,;79.91,-9.43,;81.24,-8.66,;79.92,-10.97,;78.59,-11.75,;81.25,-11.74,;82.65,-11.1,;82.96,-9.59,;83.68,-12.24,;82.92,-13.57,;81.41,-13.26,;80.27,-14.29,)|
Structure:
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