Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8872043 | 1.00 | ALDH1A1 (0.56) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL4423311 | 0.85 | ALDH1A1 (0.60) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL9000301 | 0.84 | GPR35 (0.51) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL7224437 | 0.84 | ALDH1A1 (0.59) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL6340425 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL6349023 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL74692 | 0.83 | CYP1A2 (0.62) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL3267301 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL258555 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TSHRL3MBTL1HPGDRAB9A | |
| SCHEMBL9690178 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TSHRL3MBTL1HPGDRAB9A |
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-0162776-A2 | Heterocyclic derivatives, process for their preparation and medicaments useful as aldose reductase inhibitors containing them | LABORATOIRES UPSA (FR) | 1985-11-27 | — | — | EP | disclosed |