Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.73 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL17162024 | 0.95 | — | — | |
| Tetrahydrofuran SCHEMBL28207752 | 0.91 | ALDH1A1 (0.73) | ALDH1A1TTRTSHR | |
| Tetrahydrofuran SCHEMBL28138338 | 0.91 | — | — | |
| Tetrahydrofuran SCHEMBL11026489 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| SCHEMBL87670 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| SCHEMBL2846103 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| SCHEMBL2848269 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| SCHEMBL2845030 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| SCHEMBL10713952 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR | |
| Cyclohexane SCHEMBL9743904 | 0.91 | ALDH1A1 (0.89) | ALDH1A1TTRTSHR |
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-106459502-A | Rubber composition, tire, bisanilino compound and anti-aging agent | 大塚化学株式会社 | 2017-02-22 | — | — | CN | disclosed |
| US-5491257-A | SURFACTANTS HAVING FLUOROALKYL GROUP, LIPOPHILIC GROUP, HYDROPHILIC GROUP IN SAME MOLECULE | DAIKIN INDUSTRIES, LTD. (JP) | 1996-02-13 | — | — | US | disclosed |