Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 13/20 | 0.37 |
| ▸ | MPEG1 | Q2M385 | 7/20 | 0.37 |
| ▸ | XIAP | P98170 | 2/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9422903 | 1.00 | HIF1A (0.43) | HIF1AEPAS1ACHEBACE1PTPN1 | |
| SCHEMBL7295070 | 1.00 | HIF1A (0.43) | HIF1AEPAS1ACHEBACE1PTPN1 | |
| SCHEMBL5409219 | 0.98 | HIF1A (0.44) | HIF1AEPAS1ACHEBACE1PTPN1 | |
| SCHEMBL18845026 | 0.84 | — | — | |
| SCHEMBL18197774 | 0.74 | ELANE (0.48) | PTPN1ALDH1A1 | |
| SCHEMBL24849580 | 0.70 | PDCD4 (0.39) | ACHEBACE1CA1CA9GPR84 | |
| SCHEMBL4530542 | 0.70 | ALOX5 (0.45) | PTPN1CYP1A1ALOX5MAPTKDM4E | |
| SCHEMBL4867436 | 0.69 | ACHE (0.43) | ACHEBACE1ALOX5MPEG1GPR84 | |
| SCHEMBL7296440 | 0.69 | PDCD4 (0.41) | GPR84DUSP3 | |
| SCHEMBL420617 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5376676-A | Process of using anti-inflammatory furanones as selective calcium channel inhibitors | ALLERGAN, INC. (US) | 1994-12-27 | — | — | US | disclosed |
| US-5045564-A | Calcium channel antagonists | ALLERGAN, INC. (US) | 1991-09-03 | — | — | US | disclosed |
| EP-0372940-A2 | Anti-inflammatory 2-furanones | ALLERGAN, INC (US) | 1990-06-13 | — | — | EP | disclosed |