Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9479084 | 1.00 | KDM4E (0.50) | KDM4EFDPSENPP2AKR1C3TRPA1 | |
| SCHEMBL10846493 | 0.79 | KDM4E (0.64) | KDM4EFDPSENPP2ALDH1A1ESR1 | |
| SCHEMBL9004477 | 0.79 | TRPA1 (0.48) | KDM4ETRPA1ALDH1A1TSHRCES2 | |
| SCHEMBL9004476 | 0.79 | TRPA1 (0.48) | KDM4ETRPA1ALDH1A1TSHRCES2 | |
| SCHEMBL3144474 | 0.79 | KDM4E (0.64) | KDM4EFDPSENPP2ALDH1A1ESR1 | |
| SCHEMBL10506198 | 0.79 | KDM4E (0.50) | KDM4EFDPSENPP2AKR1C3ESR1 | |
| SCHEMBL11444224 | 0.79 | KDM4E (0.55) | KDM4EFDPSENPP2AKR1C3ALDH1A1 | |
| SCHEMBL21457286 | 0.79 | KDM4E (0.55) | KDM4EFDPSENPP2AKR1C3ALDH1A1 | |
| SCHEMBL18160984 | 0.79 | KDM4E (0.50) | KDM4EFDPSENPP2AKR1C3ESR1 | |
| SCHEMBL10506200 | 0.79 | KDM4E (0.50) | KDM4EFDPSENPP2AKR1C3ESR1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5234942-A | Treating allergic pulmonary disorders, asthma | ICI AMERICAS INC. (US) | 1993-08-10 | — | — | US | disclosed |
| US-4997844-A | Compounds for the treatment of allergic or inflammatory diseases or shock conditions | ICI AMERICAS INC. (US) | 1991-03-05 | — | — | US | disclosed |
| EP-0179619-B1 | HETEROCYCLIC AMIDES | ICI AMERICAS INC. (US) | 1990-09-05 | — | — | EP | disclosed |
| US-4847404-A | FLUORESCENT DYES, OPTICAL BRIGHTENERS | CIBA-GEIGY CORPORATION (US) | 1989-07-11 | — | — | US | disclosed |
| US-4780558-A | CHEMICAL INTERMEDIATES FOR STILBENE FLUORESCENT WHITENING AGENTS | CIBA-GEIGY CORPORATION (US) | 1988-10-25 | — | — | US | disclosed |
| EP-0179619-A1 | Heterocyclic amides | ICI AMERICAS INC. (US) | 1986-04-30 | — | — | EP | disclosed |
| US-4482496-A | WHITENERS | CIBA-GEIGY CORPORATION (US) | 1984-11-13 | — | — | US | disclosed |
| US-4366189-A | WHITENERS | CIBA-GEIGY CORPORATION (US) | 1982-12-28 | — | — | US | disclosed |
| US-4226878-A | ANTIINFLAMMATORY, HYPOTENSIVES, ANTIHISTAMINES | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 1980-10-07 | — | — | US | disclosed |