Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | XBP1 | P17861 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | DHODH | Q02127 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.41 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | NR4A3 | Q92570 | 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 | |
|---|---|---|---|---|
| SCHEMBL3129088 | 0.86 | MAPT (0.67) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL7572160 | 0.83 | ALDH1A1 (0.64) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL10651600 | 0.83 | ALDH1A1 (0.71) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL11335661 | 0.81 | DHODH (0.62) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL11335664 | 0.81 | DHODH (0.62) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL10655256 | 0.81 | ALDH1A1 (0.73) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL2443924 | 0.80 | NPSR1 (0.71) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL1416827 | 0.79 | ALDH1A1 (1.00) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL5914784 | 0.78 | CES2 (0.51) | ALDH1A1MAPTXBP1MAPK1RAB9A | |
| SCHEMBL5914790 | 0.78 | CES2 (0.51) | ALDH1A1MAPTXBP1MAPK1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0273602-A1 | 3-Cyano-4-arylthiophenes | ELI LILLY AND COMPANY (US) | 1988-07-06 | — | — | EP | disclosed |