Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27699453 | 0.85 | ALDH1A1 (0.41) | IDH1ALDH1A1KDM4EHSD17B10ALOX15 | |
| SCHEMBL27699297 | 0.73 | ELANE (0.46) | ALDH1A1KDM4EKMT2AMEN1GAA | |
| SCHEMBL27699452 | 0.72 | KDM4E (0.70) | ALDH1A1KDM4EHSD17B10ALOX15KMT2A | |
| SCHEMBL4491252 | 0.72 | KDM4E (0.68) | ALDH1A1KDM4EHSD17B10ALOX15KMT2A | |
| SCHEMBL4496457 | 0.72 | KDM4E (0.52) | IDH1ALDH1A1KDM4EHSD17B10ALOX15 | |
| SCHEMBL8649730 | 0.71 | CASP1 (0.52) | ALDH1A1KDM4EHSD17B10GAAHPGD | |
| SCHEMBL646079 | 0.71 | CASP1 (0.52) | ALDH1A1KDM4EKMT2AMEN1HPGD | |
| SCHEMBL27719799 | 0.68 | CALM1 (0.41) | IDH1ALDH1A1KDM4EHSD17B10ALOX15 | |
| SCHEMBL8875551 | 0.67 | ALDH1A1 (0.38) | ALDH1A1KDM4EHSD17B10ALOX15KMT2A | |
| SCHEMBL531085 | 0.65 | ELANE (0.61) | ALDH1A1HSD17B10KMT2AGAALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101146769-A | Azolylacylguanidines as beta-secretase inhibitors | WYETH CORP (US) | 2008-03-19 | — | — | CN | disclosed |