Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL576105 | 0.85 | ACHE (0.58) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| SCHEMBL29468620 | 0.85 | ACHE (0.58) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| SCHEMBL11122557 | 0.81 | ACHE (0.52) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| SCHEMBL11321246 | 0.81 | ACHE (0.52) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| SCHEMBL5043777 | 0.81 | — | — | |
| SCHEMBL31325162 | 0.81 | — | — | |
| SCHEMBL11310830 | 0.79 | ACHE (0.50) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| SCHEMBL3883625 | 0.79 | HPGD (0.57) | ACHEALDH1A1MAPK1HTR3ASMN1; SMN2 | |
| SCHEMBL3882269 | 0.79 | ACHE (0.50) | ACHEALDH1A1MAPK1PARP1IDO1 | |
| Fluoride SCHEMBL1635597 | 0.79 | ACHE (0.50) | ACHEALDH1A1MAPK1TAAR1PARP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0775696-B1 | AMINO ACID AMIDE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AGROHORTICULTURAL FUNGICIDE, AND FUNGICIDAL METHOD | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2000-07-19 | — | — | EP | disclosed |
| US-5789428-A | Amino-acid amide derivatives, processes for preparing the same, agricultural or horticultural fungicides, and method for killing fungi | KUMIAI CHEMICAL INDUSTRY CO. LTD. (JP) | 1998-08-04 | — | — | US | disclosed |
| EP-0775696-A1 | AMINO ACID AMIDE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AGROHORTICULTURAL FUNGICIDE, AND FUNGICIDAL METHOD | KumaiI Chemical Industry Co., Ltd. (JP) | 1997-05-28 | — | — | EP | disclosed |