Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29266808 | 0.92 | ALDH1A1 (0.56) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 | |
| SCHEMBL30992115 | 0.89 | ALDH1A1 (0.53) | ALDH1A1HSD17B10MAOAHTTSMN1; SMN2 | |
| Methylamine SCHEMBL27430084 | 0.83 | ALDH1A1 (0.60) | ALDH1A1HSD17B10CYP3A4TAAR1TDP1 | |
| SCHEMBL30913008 | 0.80 | ALDH1A1 (0.73) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 | |
| SCHEMBL16503955 | 0.80 | MAOA (0.50) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 | |
| SCHEMBL29210837 | 0.80 | ALDH1A1 (0.73) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 | |
| SCHEMBL21230086 | 0.80 | HTR7 (0.47) | ALDH1A1SMN1; SMN2BACE1NPC1RAB9A | |
| SCHEMBL26798848 | 0.80 | PDCD1 (0.50) | ALDH1A1MAOACYP3A4HTTSMN1; SMN2 | |
| SCHEMBL481505 | 0.80 | ALDH1A1 (0.75) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 | |
| SCHEMBL8452262 | 0.80 | ALDH1A1 (0.75) | ALDH1A1HSD17B10MAOACYP3A4TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107759559-A | Compound and organic electronic device thereof | 彩丰精技股份有限公司 | 2018-03-06 | — | — | CN | disclosed |