Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.62 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.50 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.50 |
| ▸ | NPY1R | P25929 | 1/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
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 SCHEMBL9588155 | 0.99 | ALDH1A1 (0.66) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9538697 | 0.88 | ALDH1A1 (0.74) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| Hydrochloric Acid SCHEMBL9586835 | 0.87 | ALDH1A1 (0.72) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9588898 | 0.85 | ALDH1A1 (0.90) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9534572 | 0.85 | ALDH1A1 (0.64) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9537114 | 0.85 | ALDH1A1 (0.64) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| Hydrochloric Acid SCHEMBL9588479 | 0.84 | ALDH1A1 (0.63) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| Hydrochloric Acid SCHEMBL9587788 | 0.84 | ALDH1A1 (0.63) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9536912 | 0.83 | KMT2A (0.74) | ALDH1A1KDM4EKMT2AHTTLMNA | |
| SCHEMBL9535995 | 0.80 | NPY1R (0.65) | KDM4EKMT2ALMNAMEN1TP53 |
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 |