Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.51 |
| ▸ | DHCR7 | Q9UBM7 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10662154 | 0.99 | MAOA (0.59) | MAOADRD2DRD1DRD3SIGMAR1 | |
| Veradoline SCHEMBL29388371 | 0.91 | MAOA (0.53) | MAOAMAPK1KDM4EALDH1A1ABCB1 | |
| Veradoline SCHEMBL489286 | 0.91 | MAOA (0.53) | MAOAMAPK1KDM4EALDH1A1ABCB1 | |
| Veradoline SCHEMBL10656736 | 0.90 | MAOA (0.55) | MAOAMAPK1KDM4EALDH1A1ABCB1 | |
| Veradoline SCHEMBL125027 | 0.90 | MAOA (0.55) | MAOAMAPK1KDM4EALDH1A1ABCB1 | |
| SCHEMBL10659587 | 0.89 | MAOA (0.52) | MAOADRD2DRD1DRD3SIGMAR1 | |
| Bromide SCHEMBL10656534 | 0.88 | MAOA (0.51) | MAOADRD2DRD1DRD3SIGMAR1 | |
| SCHEMBL10662687 | 0.84 | KDM4E (0.61) | MAOADRD2DRD1DRD3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10662226 | 0.83 | KDM4E (0.60) | MAOADRD2DRD1DRD3SIGMAR1 | |
| SCHEMBL10659360 | 0.81 | CA1 (0.49) | DRD2DRD1DRD3SIGMAR1ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4766131-A | 2-amino (or hydroxy) phenethyl-1,2,3,4-tetrahydroisoquinolines as analgesics | PENNWALT CORPORATION (US) | 1988-08-23 | — | — | US | claimed |
| EP-0051190-A2 | N-(amino(or hydroxy) phenethyl)-1,2,3,4-tetrahydroisoquinolines, precursors thereof, and methods of preparation | PENNWALT CORPORATION (US) | 1982-05-12 | — | — | EP | claimed |