Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SCN4A | P35499 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1111410 | 0.76 | TSHR (0.44) | TSHRSMN1; SMN2MEN1NPC1RAB9A | |
| SCHEMBL6221752 | 0.76 | CA1 (0.62) | TSHRSMN1; SMN2KMT2AALDH1A1KDM4E | |
| SCHEMBL49632 | 0.76 | TSHR (0.43) | TSHRSMN1; SMN2MEN1NPC1RAB9A | |
| SCHEMBL9281834 | 0.74 | TSHR (0.42) | TSHRSMN1; SMN2MEN1NPC1RAB9A | |
| SCHEMBL19808797 | 0.74 | ALDH1A1 (0.36) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL8207291 | 0.73 | LMNA (0.43) | TSHRSMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL8975598 | 0.73 | TDP1 (0.42) | TSHRMEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL5740329 | 0.72 | — | — | |
| SCHEMBL6219566 | 0.71 | L3MBTL1 (0.38) | MEN1KMT2AACHEALDH1A1KDM4E | |
| SCHEMBL7558433 | 0.71 | HTR7 (0.38) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0543919-B1 | USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS IN THE MANUFACTURE OF A MEDICAMENT FOR TREATMENT OF CNS DISEASES | SEARLE & CO (US) | 1996-04-10 | — | — | EP | claimed |