Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.32 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.32 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818784 | 0.91 | PDE10A (0.34) | F10PDE10AABCB1ALDH1A1PKM | |
| SCHEMBL6819112 | 0.88 | ABCB1 (0.33) | F10PDE10AABCB1ALDH1A1PKM | |
| SCHEMBL6818724 | 0.85 | PDE10A (0.34) | F10PDE10AABCB1ALDH1A1PKM | |
| SCHEMBL7126301 | 0.85 | PDE10A (0.34) | F10PDE10AABCB1ALDH1A1PKM | |
| SCHEMBL6818693 | 0.82 | ALB (0.36) | F10PDE10AABCB1ALDH1A1PKM | |
| SCHEMBL6919933 | 0.82 | ALB (0.37) | PDE10AALDH1A1ALBGAA | |
| SCHEMBL6833230 | 0.78 | HIF1A (0.37) | PDE10AALDH1A1PKMNR1H4PDK1 | |
| SCHEMBL6822117 | 0.76 | HIF1A (0.37) | PDE10AALDH1A1PKMALBPDK1 | |
| SCHEMBL6815114 | 0.76 | HIF1A (0.37) | PDE10AALDH1A1GAA | |
| SCHEMBL6835780 | 0.76 | HIF1A (0.35) | PDE10AALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004018428-A1 | ANTIBACTERIAL BENZOIC ACID DERIVATIVES | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-03-04 | — | — | WO | disclosed |