Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PRKDC | P78527 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10983620 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL3612247 | 0.82 | TDP1 (0.54) | ALDH1A1TDP1MAPTCYP3A4HSD17B10 | |
| SCHEMBL12776990 | 0.81 | MAPK1 (0.53) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL25329734 | 0.81 | ALDH1A1 (0.44) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL4018068 | 0.81 | KDM4E (0.47) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL6010819 | 0.81 | EGFR (0.54) | TDP1MAPTLMNAMEN1KMT2A | |
| SCHEMBL2591957 | 0.80 | MAPK1 (0.50) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL1494444 | 0.79 | CYP1A2 (0.49) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL3921406 | 0.79 | ALDH1A1 (0.49) | ALDH1A1TDP1KDM4EMAPTCYP3A4 | |
| SCHEMBL31423166 | 0.79 | CYP1A2 (0.49) | ALDH1A1TDP1KDM4EMAPTCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105121430-A | Modulators of the retinoid-related orphan receptor gamma (ror-gamma) for use in the treatment of autoimmune and inflammatory diseases | GLAXO GROUP LTD | 2015-12-02 | — | — | CN | disclosed |