Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | CLK2 | P49760 | 1/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TOP1 | P11387 | 5/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8542038 | 1.00 | KCNH2 (0.56) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL8542029 | 0.91 | KCNH2 (0.52) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6952549 | 0.91 | KCNH2 (0.52) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL4674698 | 0.90 | CYP3A4 (0.59) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6958823 | 0.86 | CYP3A4 (0.74) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6502365 | 0.84 | KCNH2 (0.64) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL30626289 | 0.83 | KCNH2 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL29080642 | 0.83 | KCNH2 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL5236827 | 0.83 | CYP3A4 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL5236833 | 0.83 | CYP3A4 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1304329-B1 | Pyridonecarboxylic acid derivatives and their use as antibacterial agents | DAIICHI SANKYO CO LTD (JP) | 2008-10-15 | — | — | EP | disclosed |
| EP-1304329-A2 | Pyridonecarboxylic acid derivatives and their use as antibacterial agents | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2003-04-23 | — | — | EP | disclosed |
| EP-0807630-A1 | HETEROCYCLIC COMPOUNDS | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 1997-11-19 | — | — | EP | disclosed |