Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.76 |
| ▸ | TP53 | P04637 | 2/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.76 |
| ▸ | TSHR | P16473 | 2/20 | 0.76 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.76 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.76 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.76 |
| ▸ | THPO | P40225 | 1/20 | 0.76 |
| ▸ | NPC1 | O15118 | 1/20 | 0.76 |
| ▸ | MTOR | P42345 | 1/20 | 0.76 |
| ▸ | RAB9A | P51151 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.70 |
| ▸ | MEN1 | O00255 | 3/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.70 |
| ▸ | GMNN | O75496 | 1/20 | 0.70 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.70 |
| ▸ | NPY1R | P25929 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 4/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.51 |
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 SCHEMBL9589088 | 0.99 | CYP1A2 (0.74) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9538862 | 0.89 | CYP1A2 (0.62) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9538001 | 0.89 | CYP1A2 (0.62) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL9587398 | 0.88 | TP53 (0.61) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL9586438 | 0.88 | CYP1A2 (0.61) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9537748 | 0.88 | CYP1A2 (0.76) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL9587965 | 0.87 | CYP1A2 (0.74) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9538527 | 0.86 | TP53 (0.72) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9534087 | 0.85 | CYP1A2 (0.69) | CYP1A2TP53CYP3A4TSHRCYP2C19 | |
| SCHEMBL9536180 | 0.85 | TP53 (0.69) | CYP1A2TP53CYP3A4TSHRCYP2C19 |
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-0375560-B1 | ARYLOXYPROPANOLAMINOTETRALINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | ELF SANOFI (FR) | 1993-05-12 | — | — | EP | disclosed |
| EP-0375560-A1 | Aryloxypropanolaminotetralines, process for their preparation and pharmaceutical compositions containing same | ELF SANOFI (FR) | 1990-06-27 | — | — | EP | disclosed |