Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | NOS1 | P29475 | 3/20 | 0.45 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Allylbenzene SCHEMBL22207889 | 0.87 | MAOB (0.52) | IDO1NOS1NOS3NOS2MAOB | |
| Allylbenzene SCHEMBL27636637 | 0.87 | MAOB (0.57) | IDO1MAOBALDH1A1XDHTP53 | |
| Allylbenzene SCHEMBL318129 | 0.87 | MAOB (0.57) | IDO1MAOBALDH1A1XDHTP53 | |
| Allylbenzene SCHEMBL2478260 | 0.84 | MAOB (0.60) | IDO1MAOBALDH1A1XDHTP53 | |
| Allylbenzene SCHEMBL10325179 | 0.84 | MAOB (0.60) | IDO1MAOBALDH1A1XDHTP53 | |
| Allylbenzene SCHEMBL21274 | 0.84 | — | — | |
| Allylbenzene SCHEMBL27764879 | 0.83 | HTT (0.46) | IDO1NOS1NOS3NOS2MAOB | |
| Allylbenzene SCHEMBL11127861 | 0.82 | MAOB (0.52) | MAOBALDH1A1XDHTP53CYP3A4 | |
| Allylbenzene SCHEMBL8622536 | 0.82 | MAOB (0.52) | IDO1NOS1NOS3NOS2MAOB | |
| Allylbenzene SCHEMBL28158666 | 0.82 | MAOB (0.52) | MAOBALDH1A1XDHTP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4475942-A | N-Phosphonomethylglycine derivatives and herbicidal compositions containing them | GESHURI LABORATORIES LTD. (IL) | 1984-10-09 | — | — | US | disclosed |
| EP-0103055-A1 | N-phosphonomethylglycine derivatives and herbicidal compositions containing them | Geshuri Laboratories Ltd. (IL) | 1984-03-21 | — | — | EP | disclosed |