Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYTH2 | Q99418 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL7323574 | 0.92 | LMNA (0.43) | PTGS2ALDH1A1CYP2C9MAPTCYP1A2 | |
| SCHEMBL7820104 | 0.91 | MMP13 (0.45) | PTGS2ALDH1A1CYP2C9MAPTCYP1A2 | |
| SCHEMBL7316088 | 0.91 | MMP13 (0.45) | PTGS2ALDH1A1CYP2C9MAPTCYP1A2 | |
| SCHEMBL7322407 | 0.89 | THRB (0.47) | PTGS2ALDH1A1CYP2C9MAPTCYP1A2 | |
| SCHEMBL7572045 | 0.87 | PTGS2 (0.41) | PTGS2ALDH1A1CYP2C9MAPTCYP1A2 | |
| SCHEMBL7321305 | 0.85 | ALDH1A1 (0.39) | ALDH1A1CYP2C9MAPTCYP1A2CYP3A4 | |
| SCHEMBL7317773 | 0.81 | FFAR4 (0.53) | ALDH1A1CYP2C9MAPTCYP1A2CYP3A4 | |
| SCHEMBL7509306 | 0.80 | MMP9 (0.54) | PTGS2ALDH1A1CYP2C9KDM4EHPGD | |
| SCHEMBL7319849 | 0.80 | MMP9 (0.54) | PTGS2ALDH1A1CYP2C9KDM4EHPGD | |
| SCHEMBL7311144 | 0.80 | NAMPT (0.36) | PTGS2ALDH1A1CYP2C9MAPTKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5929097-A | INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME | AMERICAN CYANAMID COMPANY (US) | 1999-07-27 | — | — | US | disclosed |