Alpha-Naphthoflavone

Alpha-Naphthoflavone

SCHEMBL3665037

O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12.O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12

nearest known ligand 0.82

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 11/20 0.82
CYP1A2 P05177 10/20 0.82
CYP1B1 Q16678 10/20 0.82
ABCG2 Q9UNQ0 3/20 0.82
PRKDC P78527 3/20 0.82
PAX8 Q06710 2/20 0.82
CYP19A1 P11511 2/20 0.82
KDM4E B2RXH2 1/20 0.82
PDE5A O76074 1/20 0.82
ALDH1A1 P00352 1/20 0.82
TP53 P04637 1/20 0.82
ABCB1 P08183 1/20 0.82
CYP3A4 P08684 1/20 0.82
CYP2D6 P10635 1/20 0.82
MAPT P10636 1/20 0.82
CYP2C9 P11712 1/20 0.82
HPGD P15428 1/20 0.82
TSHR P16473 1/20 0.82
CYP2B6 P20813 1/20 0.82
TACR2 P21452 1/20 0.82

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
Beta-Naphthoflavone SCHEMBL29881204 0.90 ABCG2 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Beta-Naphthoflavone SCHEMBL29357406 0.90 ABCG2 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Alpha-Naphthoflavone SCHEMBL29351090 0.90 CYP1A1 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Alpha-Naphthoflavone SCHEMBL121594 0.90 CYP1A1 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Beta-Naphthoflavone SCHEMBL43538 0.90 ABCG2 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Alpha-Naphthoflavone SCHEMBL1906540 0.83 CYP1A1 (0.80) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
Alpha-Naphthoflavone SCHEMBL17292887 0.83 CYP1A1 (0.84) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
SCHEMBL13066020 0.80 TDP1 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PAX8
SCHEMBL30917246 0.80 CYP1A1 (1.00) CYP1A1CYP1A2CYP1B1ABCG2PRKDC
SCHEMBL15397111 0.80 AHR (0.78) CYP1A1CYP1A2ABCG2PAX8TP53

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-2237775-A1 COMPOSITION FOR TOPICAL USE Saurat, Jean Hilaire (CH) 2010-10-13 EP claimed
WO-2009093207-A1 COMPOSITION FOR TOPICAL USE SAURAT JEAN HILAIRE (CH) 2009-07-30 WO claimed