Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CNR2 | P34972 | 2/20 | 0.49 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.48 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.48 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | F7 | P08709 | 1/20 | 0.46 |
| ▸ | F3 | P13726 | 1/20 | 0.46 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.46 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL31369140 | 0.81 | GAA (0.56) | ALDH1A1CNR2GAALMNASMN1; SMN2 | |
| SCHEMBL3717986 | 0.81 | GAA (0.56) | ALDH1A1CNR2GAALMNASMN1; SMN2 | |
| SCHEMBL746794 | 0.77 | LMNA (0.64) | CNR2GAALMNASMN1; SMN2 | |
| SCHEMBL7289960 | 0.77 | AKR1C3 (0.66) | ALDH1A1PLOD2GAAAPPHCAR3 | |
| SCHEMBL22426419 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PLOD2GAAAPPHCAR3 | |
| SCHEMBL9830800 | 0.76 | ALDH1A1 (0.46) | ALDH1A1PLOD2PLOD3PLOD1GAA | |
| SCHEMBL3251235 | 0.76 | ALDH1A1 (0.52) | ALDH1A1PLOD2GAAAPPHCAR3 | |
| SCHEMBL6950942 | 0.76 | GAA (0.65) | ALDH1A1PLOD2GAAAPPHCAR3 | |
| SCHEMBL27951998 | 0.76 | TBXAS1 (0.53) | ALDH1A1PLOD2GAAAPPHCAR3 | |
| SCHEMBL6770549 | 0.76 | HPGD (0.59) | ALDH1A1PLOD2GAAAPPHCAR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0221601-B1 | [[[(3-Pyridinyl)methylen]amino]oxy]alkanoic acids and esters | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-10 | — | — | EP | disclosed |
| US-5180832-A | Chemical intermediate for thromboxane A2 inhibitor | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-01-19 | — | — | US | disclosed |
| US-4963573-A | INHIBIT BIOSYNTHESIS OF THROMBOXANE A2 | JANSSEN PHARMACEUTICA N.V. (BE) | 1990-10-16 | — | — | US | disclosed |
| US-4746671-A | THROMBOXANE SYNTHETASE INHIBITION | JANSSEN PHARMACEUTICA N.V. (BE) | 1988-05-24 | — | — | US | disclosed |