Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 3/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.53 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL16268280 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28048651 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL1357375 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL16268099 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL15422580 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL16267961 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL18154629 | 0.98 | TSHR (0.61) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28825285 | 0.94 | MEN1 (0.66) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28700897 | 0.94 | ALDH1A1 (0.55) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| SCHEMBL28684817 | 0.94 | ALDH1A1 (0.55) | ALDH1A1TSHRLMNATP53CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114163407-B | Furan ring component for inhibiting or killing microorganism, product containing the same and application thereof | 中国科学院宁波材料技术与工程研究所 | 2023-10-24 | — | — | CN | disclosed |
| CN-114163407-A | Furan ring composition for inhibiting or killing microorganism, product containing furan ring composition and application of furan ring composition | 中国科学院宁波材料技术与工程研究所 | 2022-03-11 | — | — | CN | disclosed |