Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | THPO | P40225 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9798727 | 0.89 | TDP1 (0.60) | ADRB2ADRB1LMNAADRA1DADRA1A | |
| Diphenylacetic Acid SCHEMBL9799481 | 0.85 | MEN1 (0.65) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| SCHEMBL7267140 | 0.83 | ALDH1A1 (0.74) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| Phenylacetic Acid SCHEMBL10573650 | 0.81 | ALDH1A1 (0.70) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| SCHEMBL11075561 | 0.79 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| SCHEMBL9799095 | 0.79 | NPY1R (0.59) | MEN1KMT2AADRB2ADRB1ADRA1A | |
| SCHEMBL9683318 | 0.77 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| Hydrochloric Acid SCHEMBL9684267 | 0.76 | DPP4 (0.54) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| Hydrochloric Acid SCHEMBL9684257 | 0.76 | DPP4 (0.54) | ALDH1A1MEN1KMT2AADRB2ADRB1 | |
| SCHEMBL11071851 | 0.75 | ADRB1 (0.65) | ALDH1A1MEN1KMT2AADRB2ADRB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0229947-B1 | NOVEL CRYSTALLINE SALTS OF ARYLOXY-PROPANOLAMINES, THEIR PREPARATION AND THEIR USE | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1991-03-13 | — | — | EP | disclosed |
| US-4849530-A | Process for the preparation of crystalline salts or aryloxy-propanolamines | RORER PHARMACEUTICAL CORPORATION (US) | 1989-07-18 | — | — | US | disclosed |
| US-4767784-A | DIPHENYLACETATES | RORER PHARMACEUTICAL CORPORATION | 1988-08-30 | — | — | US | disclosed |
| EP-0229947-A1 | Novel crystalline salts of aryloxy-propanolamines, their preparation and their use | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1987-07-29 | — | — | EP | disclosed |