Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PER2 | O15055 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27010080 | 0.79 | TAAR1 (0.41) | TAAR1NPSR1ACHEESR1ALDH1A1 | |
| SCHEMBL2545750 | 0.74 | HSPA5 (0.36) | TAAR1ALDH1A1L3MBTL1MEN1KMT2A | |
| SCHEMBL4696621 | 0.74 | ALDH1A1 (0.41) | TAAR1NPSR1ESR1ALDH1A1L3MBTL1 | |
| SCHEMBL18287360 | 0.73 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1MEN1KMT2AGAA | |
| SCHEMBL2038945 | 0.73 | ACHE (0.43) | ACHEESR1ALDH1A1LMNA | |
| SCHEMBL27536285 | 0.73 | PSEN1 (0.39) | ALDH1A1L3MBTL1CES2CES1MEN1 | |
| SCHEMBL29419644 | 0.72 | MAPT (0.44) | TAAR1ACHEESR1ALDH1A1L3MBTL1 | |
| SCHEMBL14403357 | 0.72 | ACHE (0.43) | TAAR1ACHEESR1ALDH1A1L3MBTL1 | |
| SCHEMBL3835199 | 0.72 | MAPT (0.44) | TAAR1ACHEESR1ALDH1A1L3MBTL1 | |
| SCHEMBL6265614 | 0.72 | ALDH1A1 (0.42) | TAAR1NPSR1ESR1ALDH1A1PER2 |
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-5068435-A | Alkylation of amines with alkenes in the presence of alumina catalyst | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0334332-A1 | Ortho-alkylated aromatic amines via gamma alumina catalyst | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1989-09-27 | — | — | EP | disclosed |