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BDBM351934 US9802904, 66

SMILES: CC(C)c1ccccc1-c1nc(C)c(C)c(NCc2ccc(cc2)-c2ccccc2)n1

InChI Key: InChIKey=ZNJXHHPWNNHGRG-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 351934   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
USP1/UAF1


(Homo sapiens (Human))
BDBM351934
PNG
(US9802904, 66)
Show SMILES CC(C)c1ccccc1-c1nc(C)c(C)c(NCc2ccc(cc2)-c2ccccc2)n1
Show InChI InChI=1S/C28H29N3/c1-19(2)25-12-8-9-13-26(25)28-30-21(4)20(3)27(31-28)29-18-22-14-16-24(17-15-22)23-10-6-5-7-11-23/h5-17,19H,18H2,1-4H3,(H,29,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem
US Patent
n/an/a 140n/an/an/an/an/an/a



The United States of America, as represented by the Secretary, Department of Health and Human Services; University of Delaware

US Patent


Assay Description
This example demonstrates reversible inhibition of USP1/UAF1 by an embodiment of the invention.The compound (81) at a concentration of ten times its ...


US Patent US9802904 (2017)


BindingDB Entry DOI: 10.7270/Q2TF00H8
More data for this
Ligand-Target Pair