Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 8/20 | 0.41 |
| ▸ | HRH1 | P35367 | 8/20 | 0.41 |
| ▸ | METAP1 | P53582 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 7/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14406030 | 0.78 | HTR2A (0.57) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| Hydrochloric Acid SCHEMBL9273573 | 0.77 | METAP1 (0.47) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| Hydrochloric Acid SCHEMBL9273659 | 0.77 | HTR2A (0.37) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| Hydrochloric Acid SCHEMBL9275186 | 0.75 | METAP1 (0.49) | METAP1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL12767461 | 0.75 | HTR2A (0.40) | HTR2AHRH1SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL9279969 | 0.74 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| SCHEMBL12767463 | 0.73 | RYR2 (0.32) | DRD2 | |
| Hydrochloric Acid SCHEMBL9786999 | 0.72 | SIGMAR1 (0.44) | HTR2AHTR2CHTR2BHRH3 | |
| SCHEMBL10781695 | 0.72 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDALOX12TDP1 | |
| Hydrochloric Acid SCHEMBL9275607 | 0.72 | CHRM2 (0.39) | ALDH1A1MAPTHPGDALOX12TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0389425-B1 | Benzotiopyranyl amines | CIBA GEIGY AG (CH) | 1995-04-26 | — | — | EP | disclosed |
| US-5071858-A | Antipsychotic benzothiopyranylamines | CIBA-GEIGY CORPORATION (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0389425-A1 | Benzotiopyranyl amines | CIBA-GEIGY AG (CH) | 1990-09-26 | — | — | EP | disclosed |