Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADK | P55263 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29071974 | 0.76 | CMA1 (0.47) | SMN1; SMN2TP53THRBALDH1A1GSK3B | |
| SCHEMBL16108507 | 0.72 | ALDH1A1 (0.52) | SMN1; SMN2TP53THRBALDH1A1CYP3A4 | |
| SCHEMBL11725270 | 0.68 | LMNA (0.41) | SMN1; SMN2ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6668852 | 0.66 | L3MBTL1 (0.56) | ALDH1A1GSK3BMAPTL3MBTL1ADK | |
| SCHEMBL19410712 | 0.66 | GSK3B (0.53) | GSK3BL3MBTL1ADKMEN1KMT2A | |
| SCHEMBL15973495 | 0.66 | TNF (0.53) | GSK3BL3MBTL1MEN1KMT2ACMA1 | |
| SCHEMBL11468063 | 0.66 | PDE6D (0.42) | SMN1; SMN2ALDH1A1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL13793156 | 0.66 | TNF (0.47) | ALDH1A1GSK3BMAPTL3MBTL1MEN1 | |
| SCHEMBL11472434 | 0.65 | LMNA (0.44) | ALDH1A1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23536455 | 0.65 | GSK3B (0.67) | SMN1; SMN2TP53ALDH1A1GSK3BMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6358959-B1 | FOR THERAPY OF BENIGN PROSTATIC HYPERPLASIA | MERCK & CO., INC. | 2002-03-19 | — | — | US | disclosed |
| WO-2000043374-A1 | POLYAZANAPHTHALENONE DERIVATIVES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-07-27 | — | — | WO | disclosed |