Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 6/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9542136 | 0.94 | CA2 (0.36) | ALDH1A1LMNAMAPTCA2CA12 | |
| SCHEMBL9568576 | 0.91 | HTT (0.38) | ALDH1A1LMNAMAPTCA2CA12 | |
| SCHEMBL8971719 | 0.83 | CA2 (0.42) | ALDH1A1LMNAMAPTCA2CA12 | |
| SCHEMBL16028576 | 0.83 | CYP1A2 (0.36) | ALDH1A1LMNAMAPTCA2CA12 | |
| SCHEMBL18142227 | 0.81 | ALDH1A1 (0.34) | NR1I2ALDH1A1LMNAMAPTS1PR3 | |
| SCHEMBL9615906 | 0.80 | HTT (0.43) | ALDH1A1LMNAMAPTHTTSNCA | |
| SCHEMBL8813449 | 0.78 | LMNA (0.43) | ALDH1A1LMNAMAPTHTTS1PR3 | |
| SCHEMBL600325 | 0.78 | ALDH1A1 (0.36) | ALDH1A1LMNAMAPTHTTS1PR3 | |
| SCHEMBL2074919 | 0.77 | HTT (0.35) | ALDH1A1LMNAMAPTHTTS1PR3 | |
| SCHEMBL644415 | 0.76 | CYP1A2 (0.36) | ALDH1A1LMNAMAPTHTTSNCA |
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-0542497-A1 | Heterocyclic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1993-05-19 | — | — | EP | disclosed |