Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.59 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.59 |
| ▸ | FYN | P06241 | 1/20 | 0.59 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PRKDC | P78527 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11752604 | 0.86 | AHR (0.55) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL11745063 | 0.85 | AHR (0.54) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL11745560 | 0.83 | AHR (0.51) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL2682205 | 0.76 | AHR (0.57) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL11748262 | 0.76 | AHR (0.54) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| Beta-Naphthoflavone SCHEMBL29357406 | 0.74 | ABCG2 (1.00) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| Beta-Naphthoflavone SCHEMBL43538 | 0.74 | ABCG2 (1.00) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL12325515 | 0.74 | AHR (0.59) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| Beta-Naphthoflavone SCHEMBL29881204 | 0.74 | ABCG2 (1.00) | AHRABCG2PAX8CYP1A2CYP1A1 | |
| SCHEMBL11550404 | 0.73 | AHR (0.57) | AHRABCG2PAX8CYP1A2CYP1A1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4001424-A | 1-Oxo-1H-naphtho [2,1-b] pyran derivatives for treating depression | CARLO ERBA S.P.A. (IT) | 1977-01-04 | — | — | US | disclosed |