Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.41 |
| ▸ | GGT1 | P19440 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6688106 | 0.98 | ALDH1A1 (0.42) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL27656174 | 0.81 | MAPK1 (0.47) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL5328398 | 0.80 | MAPK1 (0.46) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL3789543 | 0.79 | KDM4E (0.50) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL3794675 | 0.79 | PTGS2 (0.46) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL6194025 | 0.78 | MAPK1 (0.47) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL3787196 | 0.77 | MAPK1 (0.41) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL3188087 | 0.77 | KDM4E (0.50) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL11249678 | 0.77 | KDM4E (0.48) | ALDH1A1MAPK1KDM4ETSHRTDP1 | |
| SCHEMBL6691258 | 0.75 | MAPK1 (0.49) | ALDH1A1MAPK1KDM4ETSHRTDP1 |
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-20170128400-A1 | METHOD OF TREATING POST-SURGICAL ACUTE PAIN | ASSERTIO THERAPEUTICS, INC. (F/K/A DEPOMED, INC.) | 2017-05-11 | — | — | US | disclosed |
| US-20090292022-A1 | Method of Treating Post-Surgical Acute Pain | AAIPHARMA INC. (US) | 2009-11-26 | — | — | US | disclosed |