Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 13/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9309600 | 0.99 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9310929 | 0.88 | SLC6A3 (0.49) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9310595 | 0.86 | MEN1 (0.46) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| Hydrochloric Acid SCHEMBL9310545 | 0.85 | MEN1 (0.45) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9429643 | 0.83 | MEN1 (0.55) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9309083 | 0.82 | IDO1 (0.48) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| Hydrochloric Acid SCHEMBL9428451 | 0.82 | MEN1 (0.54) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9429307 | 0.81 | SIGMAR1 (0.58) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| SCHEMBL9428701 | 0.80 | SIGMAR1 (0.58) | ALDH1A1MEN1KMT2AHRH1ADRA1D | |
| Hydrochloric Acid SCHEMBL9429389 | 0.80 | SIGMAR1 (0.56) | ALDH1A1MEN1KMT2AHRH1ADRA1D |
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-5308848-A | Side effect reduction | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1994-05-03 | — | — | US | disclosed |
| EP-0452107-A1 | Pyrimidinedione derivatives and antiarrythmic agents containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-10-16 | — | — | EP | disclosed |