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SMILES: COCc1cnc2-c3c(O)c(=O)ccn3[C@H](Cn12)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=NQNDVFYVYOLQPV-HXUWFJFHSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 474363   
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
Polymerase acidic protein


()
BDBM474363
PNG
((S)-6-benzhydryl-11-hydroxy-3- (methoxymethyl)-5,6...)
Show SMILES COCc1cnc2-c3c(O)c(=O)ccn3[C@H](Cn12)C(c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C25H23N3O3/c1-31-16-19-14-26-25-23-24(30)21(29)12-13-27(23)20(15-28(19)25)22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,20,22,30H,15-16H2,1H3/t20-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 100n/an/an/an/an/an/a


TBA

Assay Description
Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2Z60S8G
More data for this
Ligand-Target Pair
Polymerase acidic protein


()
BDBM474363
PNG
((S)-6-benzhydryl-11-hydroxy-3- (methoxymethyl)-5,6...)
Show SMILES COCc1cnc2-c3c(O)c(=O)ccn3[C@H](Cn12)C(c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C25H23N3O3/c1-31-16-19-14-26-25-23-24(30)21(29)12-13-27(23)20(15-28(19)25)22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,20,22,30H,15-16H2,1H3/t20-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 100n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...


US Patent US10858366 (2020)


BindingDB Entry DOI: 10.7270/Q2KH0RDJ
More data for this
Ligand-Target Pair