Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.57 |
| ▸ | FYN | P06241 | 1/20 | 0.57 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 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 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6956680 | 0.78 | TNKS (0.58) | ABCG2KDM4EALDH1A1CYP3A4MAPT | |
| Selenium SCHEMBL30089787 | 0.77 | TNKS (0.56) | ABCG2KDM4EALDH1A1CYP3A4MAPT | |
| Beta-Naphthoflavone SCHEMBL29881204 | 0.73 | ABCG2 (1.00) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| Beta-Naphthoflavone SCHEMBL43538 | 0.73 | ABCG2 (1.00) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| SCHEMBL12325515 | 0.73 | AHR (0.59) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| SCHEMBL11748007 | 0.73 | AHR (0.59) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| Beta-Naphthoflavone SCHEMBL29357406 | 0.73 | ABCG2 (1.00) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| SCHEMBL24211354 | 0.72 | KDM4E (0.56) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| SCHEMBL2682205 | 0.72 | AHR (0.57) | AHRCYP1A2PAX8ABCG2CYP1A1 | |
| SCHEMBL6956169 | 0.71 | AR (0.61) | CYP1A2CYP1A1KDM4EALDH1A1MEN1 |
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-4151180-A | INTERMEDIATES FOR ANTIALLERGENS, ANTIHISTAMINES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1979-04-24 | — | — | US | claimed |