Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABAT | P80404 | 1/20 | 0.70 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 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 | |
|---|---|---|---|---|
| Tyramine SCHEMBL8001418 | 0.91 | TAAR1 (0.64) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| Tyramine SCHEMBL8003312 | 0.85 | TAAR1 (0.56) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| Tyramine SCHEMBL8002976 | 0.83 | TAAR1 (0.72) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| SCHEMBL63123 | 0.83 | — | — | |
| SCHEMBL7991430 | 0.82 | ABAT (0.47) | ABATTAAR1ALDH1A1KMT2AESR1 | |
| Hydrochloric Acid SCHEMBL920435 | 0.81 | ABAT (0.94) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| Water SCHEMBL8381326 | 0.81 | ABAT (0.94) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| Bromide SCHEMBL3539884 | 0.81 | ABAT (0.94) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| SCHEMBL20696075 | 0.81 | ABAT (0.94) | ABATTAAR1SLC6A2KDM4EALDH1A1 | |
| SCHEMBL27558427 | 0.81 | — | — |
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-6117996-A | COMPLEXING; SEPARATION; PURIFICATION OF PROTEINS | NOVO NORDISK A/S (DK) | 2000-09-12 | — | — | US | disclosed |