Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.43 |
| ▸ | C5 | P01031 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 7/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6170020 | 0.83 | PTGS2 (0.50) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL7202069 | 0.83 | PTGS2 (0.41) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL7202070 | 0.81 | KDM4E (0.44) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL6171377 | 0.80 | PTGS2 (0.49) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL27540484 | 0.80 | GAA (0.49) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL6171752 | 0.77 | PTGS2 (0.49) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL6171197 | 0.74 | PTGS2 (0.49) | ALDH1A1CYP1A2HPGDXBP1CYP2C19 | |
| SCHEMBL6173187 | 0.74 | PTGS2 (0.51) | ALDH1A1MAPTPTGS2MEN1KMT2A | |
| SCHEMBL6173791 | 0.74 | PTGS2 (0.51) | ALDH1A1MAPTPTGS2MEN1KMT2A | |
| SCHEMBL6171454 | 0.74 | PTGS2 (0.44) | ALDH1A1MAPTPTGS2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1045833-B1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER (US) | 2005-11-02 | — | — | EP | claimed |
| US-6608070-B1 | Useful for treatment of medical condition in which prostaglandins are implicated as pathogens | NAKAO KAZUNARI (JP) | 2003-08-19 | — | — | US | claimed |
| US-6608070-B1 | Useful for treatment of medical condition in which prostaglandins are implicated as pathogens | NAKAO KAZUNARI (JP) | 2003-08-19 | — | — | US | disclosed |