Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 8/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 8/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | NCF1 | P14598 | 1/20 | 0.39 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8838104 | 0.83 | SLC6A2 (0.40) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838018 | 0.83 | SLC6A2 (0.40) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838053 | 0.82 | ADRB2 (0.39) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838060 | 0.81 | ADRB2 (0.39) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| SCHEMBL8837930 | 0.79 | SPHK1 (0.39) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838037 | 0.77 | SLC6A2 (0.41) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| SCHEMBL8837993 | 0.76 | HRH3 (0.48) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838026 | 0.75 | ADRB2 (0.38) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8837977 | 0.75 | ADRB2 (0.38) | ITGB3ITGA2BADRB2NCF1PLD1 | |
| Hydrochloric Acid SCHEMBL8838035 | 0.75 | ADRB2 (0.38) | ITGB3ITGA2BADRB2NCF1PLD1 |
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-5700801-A | ANTIINFLAMMATORY AGENTS, BONE DISORDERS | KARL THOMAE, GMBH (DE) | 1997-12-23 | — | — | US | disclosed |