Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 7/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28287057 | 0.80 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL453913 | 0.76 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL5506050 | 0.76 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL3791049 | 0.75 | TAAR1 (0.50) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL16234241 | 0.75 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL9136930 | 0.75 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL27912646 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL11005834 | 0.75 | IDO1 (0.48) | TAAR1IDO1AGXTSLC6A4SLC6A2 | |
| SCHEMBL23358983 | 0.74 | IDO1 (0.46) | TAAR1IDO1AGXTSLC6A4LMNA | |
| SCHEMBL1427989 | 0.74 | ALDH1A1 (0.52) | TAAR1IDO1AGXTSLC6A4LMNA |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4308269-A | ANTITUMOUR AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1981-12-29 | — | — | US | disclosed |
| EP-0021173-A1 | Maytansinoids, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1981-01-07 | — | — | EP | disclosed |