Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.38 |
| ▸ | CD38 | P28907 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.36 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.36 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | IAPP | P10997 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | PPP1R15A | O75807 | 1/20 | 0.33 |
| ▸ | MELK | Q14680 | 1/20 | 0.33 |
| ▸ | PPP1R15B | Q5SWA1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5440903 | 0.84 | ERN1 (0.44) | ERN1TRPA1TSHRTLR2TLR1 | |
| SCHEMBL14198039 | 0.80 | TRPA1 (0.55) | TRPA1TSHRALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL9618491 | 0.78 | ERN1 (0.61) | ERN1TRPA1TSHRALDH1A1IAPP | |
| SCHEMBL29952063 | 0.78 | ERN1 (0.61) | ERN1CD38TSHRTLR2TLR1 | |
| SCHEMBL359233 | 0.78 | ERN1 (0.61) | ERN1CD38TSHRTLR2TLR1 | |
| SCHEMBL11407458 | 0.77 | ERN1 (0.59) | ERN1CD38TSHRTLR2TLR1 | |
| SCHEMBL30794071 | 0.77 | ERN1 (0.59) | ERN1CD38TSHRTLR2TLR1 | |
| SCHEMBL5992998 | 0.77 | ALDH1A1 (0.54) | ERN1TRPA1TSHRTLR2TLR1 | |
| SCHEMBL27400809 | 0.75 | GAA (0.42) | ERN1TLR2TLR1TLR6ALDH1A1 | |
| SCHEMBL27588840 | 0.75 | CD38 (0.40) | CD38TSHRALDH1A1IAPPHSP90AA1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5163186-A | — | — | None | — | — | JP | disclosed |
| CN-1543455-B | 3-phenoxy-4-pyridazinol derivatives and herbicidal compositions containing the same | SANKYO AGRO CO LTD | 2012-07-11 | — | — | CN | disclosed |
| JP-H05163186-A | PRODUCTION OF CATECHOL COMPOUNDS | MITSUBISHI KASEI CORP | 1993-06-29 | — | — | JP | disclosed |
| US-4647677-A | Process for preparing 2,3-dihydro-7-aminobenzofurans | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) | 1987-03-03 | — | — | US | disclosed |
| US-4594438-A | Dehydrohalogenation heating of 2,2,6-tri-halo-6-(1-halisobutyl)cyclohexanone | MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) | 1986-06-10 | — | — | US | disclosed |
| EP-0090976-B1 | 2,2-DIHALO-6-HALO-6(1-HALOISOBUTYL)CYCLOHEXANONE | MITSUBISHI KASEI CORPORATION (JP) | 1985-12-11 | — | — | EP | disclosed |
| US-4499306-A | HALOGENATION OF 2-ISOBUTYLIDENE CYCLOHEXANONE IN PRESENCE OF CATALST | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1985-02-12 | — | — | US | disclosed |
| EP-0090976-A2 | 2,2-Dihalo-6-halo-6(1-haloisobutyl)cyclohexanone | MITSUBISHI KASEI CORPORATION (JP) | 1983-10-12 | — | — | EP | disclosed |