Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 5/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690604 | 0.86 | TDP1 (0.42) | ALDH1A1HTR7DRD2DRD3ADRA1D | |
| SCHEMBL10692777 | 0.86 | OPRL1 (0.35) | ALDH1A1HTR7HTR1ADRD2DRD3 | |
| SCHEMBL10694080 | 0.84 | NPC1 (0.45) | HTR7HTR1AOPRL1SCN9A | |
| SCHEMBL10755079 | 0.81 | HTR1A (0.40) | ALDH1A1HTR7HTR1ADRD2DRD3 | |
| SCHEMBL10695992 | 0.81 | SCN9A (0.39) | ALDH1A1HTR7ADRA1DADRA1AADRA1B | |
| Oxalic Acid SCHEMBL10688530 | 0.78 | SMPD1 (0.45) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10688129 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HTR7HTR1ADRD2DRD3 | |
| SCHEMBL10689170 | 0.75 | ADRA1A (0.40) | ALDH1A1DRD2DRD3ADRA1DADRA1A | |
| SCHEMBL10691597 | 0.72 | ADRA1A (0.39) | ALDH1A1DRD2DRD3ADRA1DADRA1A | |
| SCHEMBL10694392 | 0.69 | NPC1 (0.47) | ALDH1A1HTR7OPRL1 |
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-4778793-A | CONTROLLING CALCIUM CONCENTRATION-CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-10-18 | — | — | US | disclosed |
| EP-0212216-A1 | Dihydroquinolinone derivatives, processes for their preparation, medicaments containing them, the use of these medicaments, and intermediates for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-03-04 | — | — | EP | disclosed |