Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | RGS12 | O14924 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| SCHEMBL29016298 | 1.00 | LMNA (0.41) | LMNACES2CES1TRPA1CYP3A4 | |
| SCHEMBL23046660 | 0.83 | DEGS1 (0.40) | LMNACES2CES1TRPA1CYP3A4 | |
| SCHEMBL28806587 | 0.81 | TRPA1 (0.41) | LMNACES2CES1TRPA1CYP3A4 | |
| SCHEMBL9806392 | 0.81 | TRPA1 (0.41) | LMNACES2CES1TRPA1CYP3A4 | |
| SCHEMBL27574053 | 0.80 | KDM1A (0.42) | LMNACES2CES1TRPA1CYP3A4 | |
| SCHEMBL18943205 | 0.80 | TRPA1 (0.44) | LMNATRPA1CYP3A4ADRA2CCHRM2 | |
| SCHEMBL4641824 | 0.80 | TRPA1 (0.44) | LMNATRPA1CYP3A4ADRA2CCHRM2 | |
| SCHEMBL6548210 | 0.79 | TRPA1 (0.58) | LMNATRPA1CYP3A4ADRA2CCHRM2 | |
| SCHEMBL6548208 | 0.79 | TRPA1 (0.58) | LMNATRPA1CYP3A4ADRA2CCHRM2 | |
| SCHEMBL7550545 | 0.78 | KDM1A (0.41) | LMNACES2CES1TRPA1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4153633-A | HYDROLYSIS | RHODIA, INC. (US) | 1979-05-08 | — | — | US | disclosed |
| US-4153634-A | HYDROLYTIC CRACKING | RHODIA, INC. (US) | 1979-05-08 | — | — | US | disclosed |
| US-3976700-A | FROM ACETONE AND PRENYL CHLORIDE, ALKALI METAL HYDROXIDE, NITROGEN CONTAINING CATALYST | RHODIA, INC. (US) | 1976-08-24 | — | — | US | disclosed |