Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 2/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ARG2 | P78540 | 1/20 | 0.43 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.41 |
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 SCHEMBL10325179 | 0.97 | MAOB (0.60) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL21274 | 0.97 | — | — | |
| Allylbenzene SCHEMBL2478260 | 0.97 | MAOB (0.60) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL11093121 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL1231599 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL8824163 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL15282877 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL318129 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL11029677 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 | |
| Allylbenzene SCHEMBL972481 | 0.94 | MAOB (0.57) | MAOBALDH1A1TSHRSMN1; SMN2TP53 |
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-112125807-B | Method for synthesizing n-octylamine by using loop reactor | 重庆合汇制药有限公司 | 2023-10-31 | — | — | CN | disclosed |
| US-4992185-A | Sulfurized diisobutylene or sulfurized triisobutylene or mixtures | MOBIL OIL CORPORATION (US) | 1991-02-12 | — | — | US | disclosed |