Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 5/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 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 | |
|---|---|---|---|---|
| SCHEMBL11620914 | 0.95 | HTR7 (0.57) | HTR7PTGS2ALDH1A1MAPK1DPP4 | |
| SCHEMBL11619232 | 0.82 | HTR7 (0.41) | HTR7PTGS2ALDH1A1MAPK1HPGD | |
| SCHEMBL8639269 | 0.79 | HTR7 (0.65) | HTR7ALDH1A1MAPK1DPP4HSD17B10 | |
| Hydrochloric Acid SCHEMBL17633911 | 0.76 | HTR7 (0.61) | HTR7ALDH1A1MAPK1DPP4HSD17B10 | |
| SCHEMBL8779985 | 0.74 | HTR7 (0.58) | HTR7ALDH1A1MAPK1DPP4ADRA2A | |
| SCHEMBL13044904 | 0.74 | HTR7 (0.50) | HTR7PTGS2ALDH1A1MAPK1HSD17B10 | |
| SCHEMBL13043630 | 0.74 | HTR7 (0.50) | HTR7PTGS2ALDH1A1MAPK1HSD17B10 | |
| SCHEMBL29176699 | 0.74 | IDO1 (0.47) | HTR7PTGS2ALDH1A1 | |
| SCHEMBL7093315 | 0.73 | PTGS2 (0.43) | HTR7PTGS2ALDH1A1MAPK1HSD17B10 | |
| SCHEMBL29139425 | 0.73 | HTR7 (0.49) | HTR7CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4074998-A | USING A SUBSTITUTED PHENOXYALKYLAMINE OR PHENYLTHIOALKYLAMINE | ELI LILLY AND COMPANY (US) | 1978-02-21 | — | — | US | disclosed |