Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 3/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6972963 | 0.95 | GSK3B (0.38) | TDP1GSK3BTLR7KDM4E | |
| SCHEMBL5853114 | 0.92 | TDP1 (0.37) | TDP1GSK3BTLR7KDM4EIDO1 | |
| SCHEMBL8349607 | 0.89 | TDP1 (0.32) | TDP1TLR7TRPC5 | |
| SCHEMBL14439828 | 0.86 | TDP1 (0.40) | TDP1MAPTTP53RECQL | |
| SCHEMBL6969339 | 0.86 | ALDH1A1 (0.36) | TDP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6974526 | 0.86 | TDP1 (0.32) | TDP1TLR7ALDH1A1 | |
| SCHEMBL6973218 | 0.85 | CCR2 (0.41) | TDP1KDM4EMAPTCYP2D6CYP2C9 | |
| SCHEMBL6964734 | 0.85 | TDP1 (0.33) | TDP1ALDH1A1 | |
| SCHEMBL6970649 | 0.84 | KCNH2 (0.32) | KCNH2 | |
| SCHEMBL6974348 | 0.83 | GSK3B (0.34) | TDP1GSK3BTLR7 |
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-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |