Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8518720 | 0.80 | AKR1B1 (0.48) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| SCHEMBL6922195 | 0.75 | AKR1B1 (0.57) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| SCHEMBL27648833 | 0.71 | AKR1B1 (0.60) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL9280929 | 0.69 | AKR1B1 (0.53) | AKR1B1HSPA5GABRA1GABRB2KDM4E | |
| 2-Allylphenol SCHEMBL29381085 | 0.69 | GABRA1 (0.57) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL5489147 | 0.69 | GABRA1 (0.57) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL31591833 | 0.69 | GABRA1 (0.57) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL160157 | 0.69 | GABRA1 (0.57) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| SCHEMBL8772705 | 0.68 | AKR1B1 (0.52) | AKR1B1HSPA5TSHRCYP2D6HIF1A | |
| 2-Allylphenol SCHEMBL28149005 | 0.68 | GABRA1 (0.52) | AKR1B1HSPA5TSHRCYP2D6HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0539578-B1 | COPPER-CONTAINING ORGANOMETALLIC COMPLEXES AND CONCENTRATES AND DIESEL FUELS CONTAINING SAME | LUBRIZOL CORP (US) | 1996-02-28 | — | — | EP | claimed |
| EP-0539578-B1 | COPPER-CONTAINING ORGANOMETALLIC COMPLEXES AND CONCENTRATES AND DIESEL FUELS CONTAINING SAME | LUBRIZOL CORP (US) | 1996-02-28 | — | — | EP | disclosed |