Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | PLAT | P00750 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NMT1 | P30419 | 2/20 | 0.38 |
| ▸ | NMT2 | O60551 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6004827 | 0.90 | CYP3A4 (0.44) | CYP3A4IP6K1DYRK1APLAUPLAT | |
| SCHEMBL6004179 | 0.88 | CYP3A4 (0.44) | CYP3A4IP6K1PLAUPLATNPC1 | |
| SCHEMBL6004895 | 0.87 | CYP3A4 (0.45) | CYP3A4IP6K1DYRK1APLAUPLAT | |
| SCHEMBL6004162 | 0.84 | ALDH1A1 (0.36) | ALDH1A1HSD17B10SYKAURKBINCENP | |
| SCHEMBL6005366 | 0.84 | PDGFRB (0.36) | SYKAURKBINCENP | |
| SCHEMBL6004262 | 0.84 | ALDH1A1 (0.36) | CYP3A4KDM4EALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL6004922 | 0.84 | SLC22A12 (0.39) | MAOAALDH1A1HSD17B10SYKAURKB | |
| SCHEMBL6005251 | 0.84 | PDE2A (0.39) | ALDH1A1HSD17B10AURKB | |
| SCHEMBL6005281 | 0.82 | DDR2 (0.34) | — | |
| SCHEMBL6004146 | 0.82 | SRC (0.38) | MEN1KMT2AKDM4EALDH1A1HPGD |
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 |