Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 5/20 | 0.40 |
| ▸ | CA1 | P00915 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.38 |
| ▸ | CDK2 | P24941 | 3/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL6690542 | 0.91 | RORC (0.41) | CA2ALDH1A1MEN1KMT2A | |
| SCHEMBL6685923 | 0.87 | RAB9A (0.38) | RAB9APOLB | |
| SCHEMBL6687814 | 0.83 | EPHX1 (0.40) | RAB9AKMT2A | |
| SCHEMBL5409955 | 0.83 | EPHX2 (0.47) | RAB9AALDH1A1POLB | |
| SCHEMBL6693564 | 0.82 | CDK1 (0.37) | CCNA2CDK2CCNA1CDK1 | |
| SCHEMBL5404160 | 0.82 | EPHX2 (0.46) | RAB9AALDH1A1POLB | |
| SCHEMBL6687352 | 0.81 | MAPT (0.45) | ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL6685716 | 0.81 | KDM4E (0.47) | ALDH1A1POLB | |
| SCHEMBL6685684 | 0.81 | KIF11 (0.39) | MAPK1RAB9AALDH1A1POLBRECQL | |
| SCHEMBL6686695 | 0.81 | MEN1 (0.40) | CA2MAPK1CA12CA1CA9 |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |