Nbqx

Nbqx

SCHEMBL26985644

NS(=O)(=O)c1cccc2c1c([N+](=O)[O-])cc1nc(O)c(O)nc12.[NaH].[NaH]

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.73
KDM4E B2RXH2 4/20 0.73
KMT2A Q03164 4/20 0.73
HPGD P15428 2/20 0.73
HSD17B10 Q99714 2/20 0.73
TP53 P04637 1/20 0.73
CYP1A2 P05177 1/20 0.73
PKM P14618 1/20 0.73
BLM P54132 1/20 0.73
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
GRM6 O15303 1/20 0.49
GLA P06280 1/20 0.49
THRB P10828 1/20 0.49
ALOX15 P16050 1/20 0.49
CYP2C19 P33261 1/20 0.49
GRIK1 P39086 1/20 0.49
GRIA1 P42261 1/20 0.49
GRIA2 P42262 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Nbqx SCHEMBL29412437 0.99 MAPT (0.74) MAPTKDM4EKMT2AHPGDHSD17B10
Nbqx SCHEMBL220464 0.99 MAPT (0.74) MAPTKDM4EKMT2AHPGDHSD17B10
Nbqx SCHEMBL30728067 0.98 MAPT (0.73) MAPTKDM4EKMT2AHPGDHSD17B10
Nbqx SCHEMBL2230845 0.91 MAPT (0.65) MAPTKDM4EKMT2AHPGDHSD17B10
SCHEMBL9341166 0.89 KMT2A (0.61) MAPTKDM4EKMT2AHPGDHSD17B10
SCHEMBL28120662 0.84 KMT2A (0.61) MAPTKDM4EKMT2AHPGDHSD17B10
Nbqx SCHEMBL20501770 0.84 MAPT (1.00) MAPTKDM4EKMT2AHPGDHSD17B10
SCHEMBL9670143 0.83 KDM4E (0.52) MAPTKDM4EKMT2AHPGDHSD17B10
Nbqx SCHEMBL29985796 0.83 MAPT (0.98) MAPTKDM4EKMT2AHPGDHSD17B10
SCHEMBL5044934 0.80 MAPT (0.52) MAPTKDM4EKMT2AHPGDHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024009280-A1 INTEGRATED STRESS RESPONSE INHIBITORS AND METHODS OF USING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 2024-01-11 WO disclosed