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BDBM502688 US11028101, Compound 1

SMILES: CCOc1cc(ccc1C(=O)NC[C@@H](O)[C@@H]1Cc2ccccc2CN1)C(=O)N1C2COCC1CC(O)C2

InChI Key: InChIKey=RDYDXLJIKYYSDX-ZQWDJQTLSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 502688   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein arginine N-methyltransferase 5


(Homo sapiens (Human))
BDBM502688
PNG
(US11028101, Compound 1)
Show SMILES CCOc1cc(ccc1C(=O)NC[C@@H](O)[C@@H]1Cc2ccccc2CN1)C(=O)N1C2COCC1CC(O)C2
Show InChI InChI=1S/C28H35N3O6/c1-2-37-26-10-18(28(35)31-20-11-22(32)12-21(31)16-36-15-20)7-8-23(26)27(34)30-14-25(33)24-9-17-5-3-4-6-19(17)13-29-24/h3-8,10,20-22,24-25,29,32-33H,2,9,11-16H2,1H3,(H,30,34)/t20?,21?,22?,24-,25+/m0/s1
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US Patent
n/an/a 19n/an/an/an/an/an/a



CTXT PTY LTD

US Patent


Assay Description
The 6 μL reactions are run in Greiner brand black 384-well low volume assay plates. All reactions contained assay buffer (phosphate buffered sal...


US Patent US11028101 (2021)

More data for this
Ligand-Target Pair