Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28577906 | 0.80 | HTT (0.46) | HTTCA1CA2CES2CES1 | |
| SCHEMBL28567432 | 0.79 | ALDH1A1 (0.41) | MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL28569244 | 0.74 | HTT (0.51) | HTTCA1CA2MAPTALDH1A1 | |
| SCHEMBL718100 | 0.71 | HTT (0.59) | HTTMAPTALDH1A1HSD17B10LMNA | |
| SCHEMBL3758351 | 0.71 | HTT (0.51) | HTTMAPTALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3751013 | 0.71 | HTT (0.51) | HTTMAPTALDH1A1CYP3A4LMNA | |
| SCHEMBL27293604 | 0.71 | HTT (0.51) | HTTCA1CA2MAPTALDH1A1 | |
| SCHEMBL955844 | 0.70 | CA1 (0.70) | CA1CA2CES2CES1MAPT | |
| SCHEMBL11068477 | 0.68 | HTT (0.51) | HTTMAPTALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3750773 | 0.68 | HTT (0.51) | HTTMAPTALDH1A1HSD17B10LMNA |
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-112898343-A | Hapten of organophosphorus triazophos pesticide and preparation method thereof | 中国农业科学院蔬菜花卉研究所 | 2021-06-04 | — | — | CN | claimed |
| CN-112898343-A | Hapten of organophosphorus triazophos pesticide and preparation method thereof | 中国农业科学院蔬菜花卉研究所 | 2021-06-04 | — | — | CN | disclosed |