Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10825002 | 1.00 | ALDH1A1 (0.38) | ALDH1A1TDP1GLO1LMNAHSD17B10 | |
| SCHEMBL9245453 | 0.97 | ALDH1A1 (0.36) | ALDH1A1TDP1GLO1LMNAHSD17B10 | |
| SCHEMBL7522645 | 0.97 | ALDH1A1 (0.36) | ALDH1A1TDP1GLO1LMNAHSD17B10 | |
| SCHEMBL5167976 | 0.93 | ALDH1A1 (0.33) | ALDH1A1TDP1GLO1 | |
| SCHEMBL28212797 | 0.91 | ALDH1A1 (0.32) | ALDH1A1TDP1 | |
| SCHEMBL9245461 | 0.91 | GRIK1 (0.33) | ALDH1A1TDP1FFAR3 | |
| SCHEMBL4098148 | 0.90 | ALDH1A1 (0.41) | ALDH1A1TDP1GLO1LMNAHSD17B10 | |
| SCHEMBL8360659 | 0.90 | ALDH1A1 (0.41) | ALDH1A1TDP1GLO1LMNAHSD17B10 | |
| SCHEMBL3896936 | 0.89 | CYP2D6 (0.33) | ALDH1A1TDP1CYP2D6CYP2C19 | |
| SCHEMBL3345135 | 0.89 | ALDH1A1 (0.39) | ALDH1A1TDP1HSD17B10TSHRCYP2D6 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4517381-A | HERBICIDES | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-05-14 | — | — | US | claimed |
| JP-60023357-A | — | — | None | — | — | JP | disclosed |
| JP-61167653-A | — | — | None | — | — | JP | disclosed |
| WO-2023199324-A1 | MIXTURE OF 3-HEXENYL ESTER ISOMERS AND USES THEREOF | AGAN AROMA & FINE CHEMICALS LTD. (IL) | 2023-10-19 | — | — | WO | disclosed |
| EP-1745012-A2 | COMPOSITIONS OF ALLOSTERIC HEMOGLOBIN MODIFIERS AND METHODS OF MAKING THE SAME | Allos Therapeutics, Inc. (US) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005102305-A2 | COMPOSITIONS OF ALLOSTERIC HEMOGLOBIN MODIFIERS AND METHODS OF MAKING THE SAME | ALLOS THERAPEUTICS, INC. (US) | 2005-11-03 | — | — | WO | disclosed |
| JP-S61167653-A | N-(3-HALOGENO-4-ISOPROPYLPHENYL)-2-METHYL-2-PENTENAMIDE DERIVATIVE AND SELECTIVE HERBICIDE | MITSUI TOATSU CHEM INC | 1986-07-29 | — | — | JP | disclosed |
| US-4517381-A | HERBICIDES | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-05-14 | — | — | US | disclosed |
| JP-S6023357-A | 2-METHYL-4'-ISOPROPYL-2-PENTENOYLANILIDE AND SELECTIVE HERBICIDE | MITSUI TOATSU CHEM INC | 1985-02-05 | — | — | JP | disclosed |
| US-4476273-A | Thermosetting compositions comprising conjugated diene polymers having pendant unsaturated groups and calcium carbonate | PHILLIPS PETROLEUM COMPANY (US) | 1984-10-09 | — | — | US | disclosed |