Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 2/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | PLAT | P00750 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6004285 | 0.90 | CYP3A4 (0.46) | CYP3A4IP6K1SYKAURKBINCENP | |
| SCHEMBL6004710 | 0.89 | CYP3A4 (0.42) | CYP3A4IP6K1PLAUPLATNPC1 | |
| SCHEMBL6004274 | 0.87 | TGFBR1 (0.48) | CYP3A4TGFBR1IP6K1DYRK1APLAU | |
| SCHEMBL6005265 | 0.86 | TGFBR1 (0.44) | TGFBR1SYKAURKBINCENPMAOA | |
| SCHEMBL6005330 | 0.83 | TGFBR1 (0.46) | TGFBR1SYKAURKBINCENPFFAR1 | |
| SCHEMBL6004931 | 0.80 | TGFBR1 (0.48) | CYP3A4TGFBR1DYRK1AMAOANPC1 | |
| SCHEMBL6004179 | 0.78 | CYP3A4 (0.44) | CYP3A4IP6K1PLAUPLATNPC1 | |
| SCHEMBL3906631 | 0.78 | TGFBR1 (0.53) | TGFBR1 | |
| SCHEMBL6004895 | 0.77 | CYP3A4 (0.45) | CYP3A4IP6K1DYRK1APLAUPLAT | |
| SCHEMBL6004207 | 0.75 | CYP1A2 (0.37) | TGFBR1NPC1RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1724268-A1 | COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | KIRIN BEER KABUSHIKI KAISHA (JP) | 2006-11-22 | — | — | EP | disclosed |