Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.76 |
| ▸ | DRD4 | P21917 | 3/20 | 0.63 |
| ▸ | DRD2 | P14416 | 2/20 | 0.63 |
| ▸ | HTR1A | P08908 | 5/20 | 0.60 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL11757536 | 0.91 | ALDH1A1 (0.74) | ALDH1A1POLBDRD4DRD2HTR1A | |
| Hydrochloric Acid SCHEMBL11844275 | 0.90 | ALDH1A1 (0.72) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11605903 | 0.90 | ALDH1A1 (0.72) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11476236 | 0.90 | ALDH1A1 (0.72) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11835888 | 0.87 | ALDH1A1 (0.71) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11825301 | 0.86 | ALDH1A1 (0.67) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11827046 | 0.86 | ALDH1A1 (0.67) | ALDH1A1POLBDRD4DRD2HTR1A | |
| Fluanisone SCHEMBL145054 | 0.86 | ALDH1A1 (1.00) | ALDH1A1POLBDRD4DRD2HTR1A | |
| SCHEMBL11606079 | 0.85 | ALDH1A1 (0.66) | ALDH1A1POLBDRD4DRD2HTR1A | |
| Fluanisone SCHEMBL29389457 | 0.85 | ALDH1A1 (0.98) | ALDH1A1POLBDRD4DRD2HTR1A |
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-4303663-A | ANALGESICS, NEUROLEPTICS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1981-12-01 | — | — | US | disclosed |
| US-4039670-A | BUTYROPHENONE COMPOUNDS AS PSYCHOTROPICS | SUMITOMO CHEMICAL CO., LTD. (JA) | 1977-08-02 | — | — | US | disclosed |