Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL11051190 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL13929453 | 0.92 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL12404098 | 0.92 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL3540595 | 0.84 | AKR1C3 (0.56) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL181066 | 0.84 | AKR1C3 (0.56) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL11132741 | 0.80 | KMT2A (0.50) | ALDH1A1MAPTNPC1RAB9AMEN1 | |
| SCHEMBL20599602 | 0.79 | AKR1C3 (0.50) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL21494357 | 0.78 | ALDH1A1 (0.49) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL16499642 | 0.77 | ALDH1A1 (0.52) | ALDH1A1MAPTHPGDNPSR1HSD17B10 | |
| SCHEMBL16499644 | 0.77 | ALDH1A1 (0.52) | ALDH1A1MAPTHPGDNPSR1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| JP-59141540-A | — | — | None | — | — | JP | disclosed |
| JP-S59141540-A | TRICYCLIC CARBOXYLIC ACID ESTER DERIVATIVE | CHISSO CORP | 1984-08-14 | — | — | JP | disclosed |