Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11443213 | 0.74 | HMGCR (0.44) | ALDH1A1TSHR | |
| SCHEMBL7270204 | 0.73 | TSHR (0.39) | GAATSHR | |
| SCHEMBL1515479 | 0.71 | PIK3CD (0.41) | ALDH1A1SMN1; SMN2PIK3CDPOLBMAPT | |
| SCHEMBL20852906 | 0.69 | PIK3CD (0.61) | ALDH1A1SMN1; SMN2PIK3CDPOLBMAPT | |
| SCHEMBL4528637 | 0.68 | — | — | |
| SCHEMBL18026348 | 0.67 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2POLBMAPTHPGD | |
| SCHEMBL12751809 | 0.67 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2PIK3CDPOLBMAPT | |
| SCHEMBL8962557 | 0.67 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2PIK3CDPOLBMAPT | |
| SCHEMBL4526770 | 0.67 | POLB (0.37) | ALDH1A1SMN1; SMN2POLBMAPTHPGD | |
| SCHEMBL9520629 | 0.67 | GAA (0.41) | ALDH1A1POLBLMNAGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6136853-A | FUNGICIDE; ANTIBIOTIC | MERCK & CO., INC. (US) | 2000-10-24 | — | — | US | disclosed |
| EP-0929217-A4 | SORDARIN DERIVATIVES | MERCK & CO INC (US) | 1999-12-15 | — | — | EP | disclosed |
| EP-0929217-A1 | SORDARIN DERIVATIVES | Merck & Co., Inc. (US) | 1999-07-21 | — | — | EP | disclosed |
| WO-1998015178-A1 | SORDARIN DERIVATIVES | MERCK & CO., INC. (US) | 1998-04-16 | — | — | WO | disclosed |