Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25A | P30304 | 1/20 | 0.59 |
| ▸ | CDC25B | P30305 | 1/20 | 0.59 |
| ▸ | CDC25C | P30307 | 1/20 | 0.59 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | CASP1 | P29466 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5039512 | 0.90 | CDC25A (0.61) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5043875 | 0.89 | ALDH1A1 (0.47) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5047146 | 0.88 | CDC25A (0.45) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5043800 | 0.88 | CDC25A (0.44) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5048712 | 0.88 | CDC25A (0.59) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5046853 | 0.88 | CDC25A (0.59) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5044320 | 0.87 | CDC25A (0.67) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5043937 | 0.87 | CDC25A (0.59) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5048559 | 0.87 | ALDH1A1 (0.47) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 | |
| SCHEMBL5044520 | 0.86 | ALDH1A1 (0.45) | CDC25ACDC25BCDC25CDUSP3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1583762-B1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | HOFFMANN LA ROCHE (CH) | 2008-07-09 | — | — | EP | disclosed |
| US-7135488-B2 | Pyrrolyl-thiazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2006-11-14 | — | — | US | disclosed |
| EP-1583762-A1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004060888-A1 | NOVEL CB 1 RECEPTOR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-07-22 | — | — | WO | disclosed |