Betanaphthol

Betanaphthol

SCHEMBL7005874

NN=Nc1ccccc1.Oc1ccc2ccccc2c1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.61
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
NPC1 O15118 5/20 0.58
RAB9A P51151 4/20 0.58
HSP90AA1 P07900 3/20 0.58
ESR2 Q92731 5/20 0.47
ESR1 P03372 4/20 0.47
MAPT P10636 2/20 0.42
DHODH Q02127 1/20 0.42
HSD17B1 P14061 2/20 0.42
HSD17B2 P37059 2/20 0.42
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
HTR3A P46098 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42
THRB P10828 1/20 0.41
ALOX5 P09917 1/20 0.39
LMNA P02545 1/20 0.39

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
Betanaphthol SCHEMBL7005871 1.00 CYP1A2 (0.61) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL7005877 0.83 MEN1 (0.64) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL8651479 0.80 CYP1A2 (0.94) CYP1A2MEN1KMT2ANPC1RAB9A
Phenol SCHEMBL11427408 0.78 MEN1 (0.62) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL28781 0.78 CYP1A2 (1.00) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL29658180 0.78 CYP1A2 (1.00) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL239472 0.78 CYP1A2 (1.00) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL11594695 0.78 CYP1A2 (1.00) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL10799707 0.76 CYP1A2 (0.63) CYP1A2MEN1KMT2ANPC1RAB9A
Betanaphthol SCHEMBL19547908 0.76 CYP1A2 (0.85) CYP1A2MEN1KMT2ANPC1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268634-A2 TRANSPARENT OR PARTIALLY TRANSPARENT PACKAGING MATERIALS THAT ARE COLOURED BY MEANS OF COLOURS Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2003-01-02 EP disclosed
WO-2001058996-A2 TRANSPARENT OR PARTIALLY TRANSPARENT PACKAGING MATERIALS THAT ARE COLOURED BY MEANS OF COLOURS Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2001-08-16 WO disclosed