Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 8/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | RECQL | P46063 | 5/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.56 |
| ▸ | USP2 | O75604 | 2/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.56 |
| ▸ | EGFR | P00533 | 2/20 | 0.56 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.56 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968038 | 0.82 | PLA2G1B (0.59) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL15220214 | 0.82 | PLA2G1B (0.59) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL1960568 | 0.82 | PLA2G1B (0.59) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL11441616 | 0.81 | ALOX15 (0.60) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL17244102 | 0.79 | PLA2G1B (0.65) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL22075869 | 0.78 | TAAR1 (0.57) | SLC7A5SLC6A2ESR1OPRK1TAAR1 | |
| SCHEMBL22074724 | 0.78 | TAAR1 (0.57) | SLC7A5SLC6A2ESR1OPRK1TAAR1 | |
| SCHEMBL1050423 | 0.78 | PLA2G1B (0.69) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL11051860 | 0.77 | PLA2G1B (0.57) | PLA2G1BALOX15KDM4ERECQLHIF1A | |
| SCHEMBL633687 | 0.76 | ALOX15 (0.70) | PLA2G1BALOX15KDM4ERECQLHIF1A |
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-4431817-A | ADRENERIC STIMULANTS; DECARBOXYLASE INHIBITORS; HYPOTENSIVE AGENTS; ANTISECRETORY AGENTS; ANTIULCER AGENTS | MERCK & CO., INC. (US) | 1984-02-14 | — | — | US | disclosed |
| US-4431821-A | HYPOTENSIVE AND ANTISECRETORY AGENTS; PARKINSON'S DISEASE | MERCK & CO., INC. (US) | 1984-02-14 | — | — | US | disclosed |