Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.33 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.33 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2852558 | 0.87 | CYP3A4 (0.47) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| SCHEMBL272930 | 0.87 | ALDH1A1 (0.42) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| SCHEMBL29871387 | 0.87 | CYP3A4 (0.47) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| Bromide SCHEMBL29723865 | 0.85 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| Water SCHEMBL27715056 | 0.85 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| SCHEMBL27740774 | 0.85 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| Benzo[D]Thiazole SCHEMBL7862242 | 0.84 | ALDH1A1 (0.61) | ALDH1A1HSD17B10CYP3A4NPC1RAB9A | |
| SCHEMBL7129664 | 0.84 | ALDH1A1 (0.35) | ALDH1A1HSD17B10CYP3A4MAPTMAOA | |
| Cyanide SCHEMBL8982602 | 0.82 | ALDH1A1 (0.38) | ALDH1A1HSD17B10CYP3A4LMNANPC1 | |
| SCHEMBL10461143 | 0.82 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP3A4NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4165985-A | PHOTOCONDUCTIVE, HETEROCYCLIC-SUBSTITUTED ISOQUINOLINE COLORANTS | EASTMAN KODAK COMPANY (US) | 1979-08-28 | — | — | US | disclosed |