Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.50 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.50 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 7/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | HTR1D | P28221 | 2/20 | 0.47 |
| ▸ | HTR1B | P28222 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 SCHEMBL11198122 | 0.81 | DRD2 (0.55) | SCN1ASCN5ASCN9ADRD2SLC6A4 | |
| SCHEMBL11193021 | 0.77 | SLC6A4 (0.54) | ALDH1A1DRD2SLC6A4HTR1AHTR1B | |
| SCHEMBL3436279 | 0.75 | MAPT (0.57) | ALDH1A1SLC6A4MAPTLMNASMN1; SMN2 | |
| SCHEMBL8880862 | 0.75 | DRD2 (0.53) | SCN1ASCN5ASCN9ADRD2SLC6A4 | |
| SCHEMBL11194927 | 0.74 | DRD2 (0.60) | SCN1ASCN5ASCN9ADRD2HTR1A | |
| SCHEMBL28360934 | 0.74 | ALDH1A1 (0.55) | ALDH1A1DRD2SLC6A4HTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL11203073 | 0.74 | DRD2 (0.78) | ALDH1A1SCN1ASCN5ASCN9ADRD2 | |
| SCHEMBL11196615 | 0.73 | ALDH1A1 (0.47) | ALDH1A1SCN1ASCN5ASCN9ADRD2 | |
| SCHEMBL11292144 | 0.72 | ADRB2 (0.52) | ALDH1A1DRD2HTR1AMAPTLMNA | |
| SCHEMBL11194827 | 0.72 | DRD2 (0.49) | ALDH1A1SCN1ASCN5ASCN9ADRD2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4415572-A | CARDIOTONIC AND INOTROPIC AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1983-11-15 | — | — | US | disclosed |