Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 2/20 | 0.53 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.53 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzyl Carbamate SCHEMBL11790869 | 0.83 | L3MBTL1 (0.47) | SLC1A3SLC1A2SLC1A1L3MBTL1ESR2 | |
| SCHEMBL3647551 | 0.81 | TAAR1 (0.50) | SLC1A3SLC1A2SLC1A1TAAR1L3MBTL1 | |
| SCHEMBL13044441 | 0.81 | ALDH1A1 (0.55) | SLC1A3SLC1A2SLC1A1TAAR1L3MBTL1 | |
| SCHEMBL13170592 | 0.81 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1L3MBTL1ESR2 | |
| Hydrochloric Acid SCHEMBL27717048 | 0.79 | ALDH1A1 (0.53) | SLC1A3SLC1A2SLC1A1TAAR1L3MBTL1 | |
| SCHEMBL14011319 | 0.78 | SLC1A3 (0.50) | SLC1A3SLC1A2SLC1A1L3MBTL1CYP1A2 | |
| SCHEMBL27633773 | 0.78 | SLC1A3 (0.46) | SLC1A3SLC1A2SLC1A1L3MBTL1CYP1A2 | |
| SCHEMBL30437401 | 0.77 | KMT2A (0.50) | L3MBTL1CYP1A2PARP10ALDH1A1 | |
| SCHEMBL9903115 | 0.77 | SLC1A3 (0.45) | SLC1A3SLC1A2SLC1A1TAAR1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL27555050 | 0.77 | SLC1A3 (0.45) | SLC1A3SLC1A2SLC1A1L3MBTL1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115433160-B | Analgesic active compounds and medical application thereof | 中国人民解放军军事科学院军事医学研究院 | 2023-06-30 | — | — | CN | disclosed |
| CN-115433160-A | Analgesic active compound and medical application thereof | 中国人民解放军军事科学院军事医学研究院 | 2022-12-06 | — | — | CN | disclosed |
| US-6462076-B2 | CYSTEINE PROTEASE INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES ASSOCIATED WITH CYSTEINE PROTEASES, SUCH AS OSTEOPOROSIS, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS, TUMOR METASTASIS, ANGINA PECTORIS, PLAQUE RUPTURE AND STROKE ETC. | HOFFMANN-LA ROCHE INC. | 2002-10-08 | — | — | US | disclosed |