Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CTSD | P07339 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2636255 | 0.81 | KDM4E (0.46) | KDM4EMMP9MMP13ALDH1A1KMT2A | |
| SCHEMBL962276 | 0.77 | ALDH1A1 (0.62) | P2RX7KDM4ECTSDALDH1A1CA1 | |
| SCHEMBL6683811 | 0.77 | TSHR (0.54) | ALDH1A1MAPK1L3MBTL1KMT2AMEN1 | |
| SCHEMBL10836959 | 0.75 | HTT (0.48) | KDM4EALDH1A1KMT2AMEN1HSD17B10 | |
| SCHEMBL959908 | 0.71 | CTSD (0.50) | P2RX7KDM4ECTSDALDH1A1CA1 | |
| SCHEMBL961664 | 0.71 | CTSD (0.50) | P2RX7KDM4ECTSDALDH1A1CA1 | |
| SCHEMBL10921933 | 0.71 | CTSD (0.49) | P2RX7KDM4ECTSDALDH1A1CA1 | |
| SCHEMBL31087643 | 0.70 | ALDH1A1 (0.62) | P2RX7KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL28086048 | 0.70 | ALDH1A1 (0.62) | P2RX7KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL2762268 | 0.69 | MAPT (0.46) | KDM4ECYP3A4CYP2C19ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004052280-A2 | ANTI-ANGIOGENIC COMPOUNDS AND THEIR USE IN CANCER TREATMENT | IMCLONE SYSTEMS INCORPORATED (US) | 2004-06-24 | — | — | WO | disclosed |