Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA7 | P43166 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5889514 | 0.87 | MAPT (0.62) | KDM4ECYP1A2CYP3A4MAPTMEN1 | |
| SCHEMBL553819 | 0.84 | MEN1 (0.54) | KDM4ECYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL12392923 | 0.84 | MAPT (0.60) | KDM4EMAPTHPGDCA12CA1 | |
| SCHEMBL28264535 | 0.83 | MEN1 (0.50) | KDM4ECYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL31294897 | 0.82 | MAPT (0.49) | CYP1A2CYP3A4MAPTTDP1HPGD | |
| SCHEMBL69334 | 0.80 | CA12 (0.56) | KDM4ECYP1A2CYP3A4MAPTMEN1 | |
| SCHEMBL3987986 | 0.79 | KDM4E (0.55) | KDM4ECYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL14368266 | 0.79 | MEN1 (0.51) | KDM4ECYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL30622485 | 0.79 | KDM4E (0.55) | KDM4ECYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL14744961 | 0.79 | MEN1 (0.58) | KDM4ECYP1A2CYP3A4CYP2C19MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6228868-B1 | ANTICARCINOGENIC AND ANTITUMOR AGENTS | ABBOTT LABORATORIES | 2001-05-08 | — | — | US | disclosed |
| US-6165484-A | EDTA and other chelators with or without antifungal antimicrobial agents for the prevention and treatment of fungal infections | WAKE FOREST UNIVERSITY (US) | 2000-12-26 | — | — | US | disclosed |
| WO-2000006556-A1 | SUBSTITUTED OXAZOLINES AS ANTIPROLIFERATIVE AGENTS | ABBOTT LABORATORIES (US) | 2000-02-10 | — | — | WO | disclosed |