Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 4/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.32 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | AGXT | P21549 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL11613866 | 0.83 | TRPA1 (0.42) | TRPA1TAAR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11616522 | 0.80 | TRPA1 (0.40) | CASRIDO1LOXL2TRPA1ESR1 | |
| SCHEMBL11664314 | 0.74 | TAAR1 (0.34) | CASRIDO1LOXL2TRPA1TAAR1 | |
| SCHEMBL11611923 | 0.73 | CASR (0.34) | CASRIDO1LOXL2TRPA1TAAR1 | |
| SCHEMBL11616428 | 0.71 | CASR (0.36) | CASRIDO1LOXL2TRPA1TAAR1 | |
| SCHEMBL11514157 | 0.71 | CETP (0.48) | IDO1TAAR1 | |
| SCHEMBL10248786 | 0.68 | IDO1 (0.48) | IDO1LOXL2TAAR1PLA2G1BATG4B | |
| SCHEMBL11611424 | 0.67 | IDO1 (0.38) | CASRIDO1LOXL2TAAR1PLA2G1B | |
| SCHEMBL11665621 | 0.66 | HPGD (0.36) | CASRIDO1LOXL2TRPA1ESR1 | |
| SCHEMBL5447904 | 0.65 | TRPA1 (0.47) | CASRIDO1LOXL2TRPA1TAAR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE29926-E | 2-Decarboxy-2-hydroxy-methyl-16-fluoro-PGE1 compounds | THE UPJOHN COMPANY (US) | 1979-03-06 | — | — | US | disclosed |
| US-4122282-A | PROSTAGLANDINS | THE UPJOHN COMPANY (US) | 1978-10-24 | — | — | US | disclosed |
| US-4099014-A | BLOOD PLATELET AGGREGATION INHIBITORS | THE UPJOHN COMPANY (US) | 1978-07-04 | — | — | US | disclosed |
| US-4085139-A | PROSTAGLANDINS | THE UPJOHN COMPANY (US) | 1978-04-18 | — | — | US | disclosed |
| US-4081478-A | PROSTAGLANDINS | THE UPJOHN COMPANY (US) | 1978-03-28 | — | — | US | disclosed |
| US-4073808-A | PROSTAGLANDINS | THE UPJOHN COMPANY (US) | 1978-02-14 | — | — | US | disclosed |
| US-4033989-A | 9-Deoxy-PGF2 Analogs | THE UPJOHN COMPANY (US) | 1977-07-05 | — | — | US | disclosed |
| US-4016184-A | PROSTAGLANDINS, BLOOD PLATELET AGGREGATION INHIBITORS | THE UPJOHN COMPANY (US) | 1977-04-05 | — | — | US | disclosed |