Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26244755 | 0.85 | PTPN1 (0.53) | PTPN1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL6289058 | 0.84 | PTPN1 (0.51) | PTPN1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL6290005 | 0.82 | PTPN1 (0.54) | PTPN1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL6289064 | 0.80 | PTPN1 (0.47) | PTPN1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL1250655 | 0.80 | TSHR (0.50) | PTPN1ESR1MAPTALDH1A1MEN1 | |
| SCHEMBL23399275 | 0.79 | HMGB1 (0.55) | HSD17B1ESR1MAPTNPC1SMN1; SMN2 | |
| SCHEMBL11563189 | 0.79 | HMGB1 (0.50) | PTPN1HSD17B1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL11067893 | 0.78 | HSD17B1 (0.41) | HSD17B1MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL2070725 | 0.76 | AKR1C4 (0.67) | PTPN1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL8204240 | 0.76 | MAPT (0.46) | HSD17B1MAPTRAB9AALDH1A1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0721947-B1 | Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 2001-03-14 | — | — | EP | disclosed |
| US-5703121-A | SLEEP DISORDERS | ADIR ET COMPAGNIE (FR) | 1997-12-30 | — | — | US | disclosed |
| EP-0721947-A1 | Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1996-07-17 | — | — | EP | disclosed |