Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL11525587 | 0.89 | ALDH1A1 (0.52) | ALDH1A1RAB9AL3MBTL1IDO1HTR2A | |
| SCHEMBL10885468 | 0.87 | RAB9A (0.59) | ALDH1A1RAB9AL3MBTL1IDO1HTR2A | |
| SCHEMBL11520952 | 0.80 | RAB9A (0.48) | ALDH1A1RAB9AIDO1HTR2AHTT | |
| SCHEMBL11431545 | 0.78 | MAPT (0.53) | ALDH1A1L3MBTL1NPC1SMN1; SMN2MAPT | |
| SCHEMBL9350698 | 0.77 | RAB9A (0.56) | RAB9AL3MBTL1IDO1HTR2ANPC1 | |
| SCHEMBL11686784 | 0.77 | ALDH1A1 (0.65) | ALDH1A1RAB9AL3MBTL1IDO1NPC1 | |
| SCHEMBL11216821 | 0.76 | ATM (0.53) | ALDH1A1RAB9AL3MBTL1NPC1SMN1; SMN2 | |
| SCHEMBL1013 | 0.76 | IDO1 (0.62) | ALDH1A1RAB9AIDO1HTR2AHTT | |
| SCHEMBL10885461 | 0.75 | RAB9A (0.54) | RAB9AL3MBTL1IDO1HTR2ANPC1 | |
| SCHEMBL10493299 | 0.75 | RAB9A (0.54) | RAB9AL3MBTL1IDO1HTR2ANPC1 |
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-4144391-A | REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE | ELI LILLY AND COMPANY (US) | 1979-03-13 | — | — | US | disclosed |