Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.76 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.76 |
| ▸ | MIF | P14174 | 1/20 | 0.76 |
| ▸ | PDE4A | P27815 | 1/20 | 0.76 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10415468 | 0.89 | ADORA3 (0.78) | PTGS1ADORA3MIFPDE4APDE4D | |
| Iguratimod SCHEMBL26326 | 0.87 | PTGS1 (1.00) | PTGS1ADORA3MIFPDE4APDE4D | |
| Iguratimod SCHEMBL29366981 | 0.87 | PTGS1 (1.00) | PTGS1ADORA3MIFPDE4APDE4D | |
| Iguratimod SCHEMBL5455197 | 0.86 | PTGS1 (0.98) | PTGS1ADORA3MIFPDE4APDE4D | |
| SCHEMBL10416570 | 0.84 | ADORA3 (0.54) | PTGS1ADORA3MIFPDE4APDE4D | |
| SCHEMBL7859528 | 0.83 | ADORA3 (0.63) | PTGS1ADORA3MIFPDE4APDE4D | |
| SCHEMBL10415415 | 0.82 | ADORA3 (0.52) | PTGS1ADORA3MIFPDE4APDE4D | |
| Iguratimod SCHEMBL29230458 | 0.81 | PTGS1 (0.87) | PTGS1ADORA3MIFPDE4APDE4D | |
| SCHEMBL10417305 | 0.79 | PTGS1 (0.85) | PTGS1ADORA3MIFPDE4APDE4D | |
| SCHEMBL30842776 | 0.78 | PTGS1 (0.70) | PTGS1ADORA3MIFPDE4APDE4D |
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-4954518-A | Antiinflammatory agents | TOYAMA CHEMICAL COMPANY, LTD. (JP) | 1990-09-04 | — | — | US | claimed |
| JP-2049778-A | — | — | None | — | — | JP | disclosed |
| JP-H0249778-A | NOVEL 4H-1-BENZOPYRAN-4-ONE DERIVATIVE, ITS SALT AND ANTI-INFLAMMATORY AGENT CONTAINING THE SAME | TOYAMA CHEM CO LTD | 1990-02-20 | — | — | JP | disclosed |