Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1F | P30939 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1E | P28566 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL12020910 | 0.90 | SLC6A2 (0.44) | HTR1FNPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL1197874 | 0.87 | HTR1F (0.60) | HTR1FALDH1A1LMNACHRM5DRD5 | |
| Hydrochloric Acid SCHEMBL5984136 | 0.87 | HTR1F (0.51) | HTR1FNPC1CYP1A2RAB9ACHRM5 | |
| SCHEMBL12021012 | 0.85 | HTR1F (0.50) | HTR1FNPC1RAB9AHTR1DHTR1E | |
| Hydrochloric Acid SCHEMBL5983376 | 0.85 | HTR1F (0.49) | HTR1FNPC1RAB9AHTR1DHTR1E | |
| SCHEMBL5983275 | 0.84 | MEN1 (0.54) | HTR1FNPC1CYP1A2RAB9ACHRM5 | |
| Hydrochloric Acid SCHEMBL5983739 | 0.80 | CCNA2 (0.45) | SMN1; SMN2TP53NPC1CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL5983416 | 0.80 | ALDH1A1 (0.53) | SMN1; SMN2NPC1CYP1A2CYP2C19RAB9A | |
| SCHEMBL5983353 | 0.79 | FLT3 (0.43) | HTR1FCHRM5DRD5HTR1DHTR1E | |
| SCHEMBL5983472 | 0.79 | MEN1 (0.43) | HTR1FCHRM5DRD5HTR1DHTR1E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1663971-A1 | SUBSTITUTED 2-CARBONYLAMINO-6-PIPERIDINAMINOPYRIDINES AND SUBSTITUTED 1-CARBONYLAMINO-3-PIPERIDINAMINOBENZENES AS 5-HT1F AGONISTS | Eli Lilly and Company (US) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005035499-A1 | SUBSTITUTED 2-CARBONYLAMINO-6-PIPERIDINAMINOPYRIDINES AND SUBSTITUTED 1-CARBONYLAMINO-3-PIPERIDINAMINOBENZENES AS 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 2005-04-21 | — | — | WO | disclosed |