Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28166896 | 0.92 | ALDH1A1 (0.69) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Benzene SCHEMBL28074647 | 0.92 | ALDH1A1 (0.69) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| SCHEMBL40525 | 0.92 | ALDH1A1 (0.69) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Urea SCHEMBL28373374 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Methane SCHEMBL28614489 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Fluoride SCHEMBL27889058 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Hydrogen Sulfide SCHEMBL27878891 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Hydrochloric Acid SCHEMBL30829222 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Diphenylether SCHEMBL27491152 | 0.85 | PGR (0.64) | ALDH1A1CYP1A2KMT2APOLBMAPT | |
| Naphthalene SCHEMBL27966015 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CYP1A2KMT2APOLBMAPT |
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-106359439-A | Pest control composition comprising an iminopyridine derivative | 明治制果药业株式会社 | 2017-02-01 | — | — | CN | disclosed |
| CN-104125774-B | Pest control composition comprising iminopyridine derivatives | 明治制果药业株式会社 | 2016-09-28 | — | — | CN | disclosed |