Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PDE2A | O00408 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14686232 | 0.83 | CYP1A2 (0.67) | CYP3A4CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL14686190 | 0.81 | CYP1A2 (0.50) | CYP3A4CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL4980377 | 0.81 | ALDH1A1 (0.57) | SMN1; SMN2CYP3A4L3MBTL1MEN1KMT2A | |
| SCHEMBL4349161 | 0.75 | AR (0.64) | L3MBTL1MEN1KMT2AALDH1A1CYP19A1 | |
| SCHEMBL13788783 | 0.74 | TSHR (0.51) | CYP3A4CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL19241032 | 0.73 | ALDH1A1 (0.62) | SMN1; SMN2CYP3A4L3MBTL1MEN1KMT2A | |
| SCHEMBL29451393 | 0.73 | ALDH1A1 (0.62) | SMN1; SMN2CYP3A4L3MBTL1MEN1KMT2A | |
| SCHEMBL3064070 | 0.72 | ALDH1A1 (0.60) | SMN1; SMN2CYP3A4L3MBTL1MEN1KMT2A | |
| SCHEMBL18789517 | 0.72 | IDO1 (0.44) | KMT2ATDP1ALDH1A1 | |
| SCHEMBL6535542 | 0.71 | CYP19A1 (0.58) | SMN1; SMN2L3MBTL1MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2227233-B1 | IDO INHIBITORS | NEWLINK GENETICS (US) | 2013-02-13 | — | — | EP | disclosed |