Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17954604 | 0.83 | PNMT (0.38) | TSHRSQORPNMTALDH1A1NPC1 | |
| SCHEMBL6277979 | 0.78 | PNMT (0.41) | PNMTALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL27996725 | 0.74 | PNMT (0.42) | SQORPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL17242315 | 0.74 | TRPA1 (0.51) | TSHRPNMTALDH1A1NPC1RAB9A | |
| Water SCHEMBL27971077 | 0.73 | PNMT (0.52) | TSHRPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL27878508 | 0.71 | PNMT (0.53) | TSHRPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL135721 | 0.71 | PNMT (0.53) | TSHRPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL25337616 | 0.70 | PNMT (0.41) | TSHRPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL2355804 | 0.70 | SMN1; SMN2 (0.53) | TSHRPNMTALDH1A1NPC1RAB9A | |
| SCHEMBL31441011 | 0.70 | SMN1; SMN2 (0.53) | TSHRPNMTALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101096337-A | Aralkyl carboxylic acid, preparation method and application thereof | SANOFI SYNTHELABO (FR) | 2008-01-02 | — | — | CN | disclosed |
| CN-100335464-C | Aralkyl-tetrahydro-pyridines, process for their preparation and pharmaceutical compositions containing them | SANOFI SYNTHELABO (FR) | 2007-09-05 | — | — | CN | disclosed |
| CN-1571770-A | Aralkyl-tetrahydro-pyridines, process for their preparation and pharmaceutical compositions containing them | SANOFI SYNTHELABO (FR) | 2005-01-26 | — | — | CN | disclosed |