Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | HPN | P05981 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2851340 | 1.00 | GAA (0.45) | GAALMNAPLAUHPNBCHE | |
| SCHEMBL1144622 | 0.82 | ALDH1A1 (0.47) | GAAALDH1A1RECQLCA2CA7 | |
| SCHEMBL28344807 | 0.82 | ALPI (0.47) | GAALMNAPLAUHPNBCHE | |
| Ammonia Solution, Strong SCHEMBL20267961 | 0.81 | ALPI (0.46) | GAALMNAPLAUHPNBCHE | |
| Ammonia Solution, Strong SCHEMBL20267854 | 0.81 | ALPI (0.46) | GAALMNAPLAUHPNBCHE | |
| SCHEMBL10590019 | 0.80 | ALDH1A1 (0.47) | LMNAALDH1A1RECQLCA2CA7 | |
| SCHEMBL2853515 | 0.79 | ALDH1A1 (0.50) | GAAACHEALDH1A1CA2CA7 | |
| SCHEMBL5846632 | 0.79 | ALDH1A1 (0.50) | GAAACHEALDH1A1CA2CA7 | |
| SCHEMBL2851338 | 0.79 | GAA (0.47) | GAABCHEACHEALDH1A1RECQL | |
| SCHEMBL27485100 | 0.77 | EPHX1 (0.43) | KMT2AEPHX1CYP1A2 |
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-5250542-A | Prevention of side effects induced by narcotics used as analgesics such as constipation, nausea and vomiting; 1-carboxyalkyl-4-methyl-4-(3-oxyphenyl)piperidines such as alvimopan | ELI LILLY AND COMPANY (US) | 1993-10-05 | — | — | US | disclosed |