Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8846760 | 0.84 | MEN1 (0.61) | KDM4ECYP2C9CYP2C19CYP1A2MEN1 | |
| SCHEMBL8846787 | 0.84 | USP2 (0.62) | ALDH1A1KDM4ECYP2C9CYP2C19CYP1A2 | |
| SCHEMBL2554470 | 0.81 | CYP1A2 (0.67) | ALDH1A1KDM4ECYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9152872 | 0.80 | ALDH1A1 (0.66) | ALDH1A1KDM4ECYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9152126 | 0.79 | KMT2A (0.56) | ALDH1A1CYP2C9CYP2C19MEN1KMT2A | |
| SCHEMBL2555132 | 0.78 | ALDH1A1 (0.59) | ALDH1A1KDM4ECYP1A2NPC1 | |
| SCHEMBL9152090 | 0.78 | PTGDR2 (0.51) | ALDH1A1KDM4ECYP2C9CYP2C19MEN1 | |
| SCHEMBL7364250 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL2557379 | 0.76 | ALDH1A1 (0.59) | ALDH1A1CYP2C9CYP2C19CYP1A2MEN1 | |
| SCHEMBL3021167 | 0.76 | CA12 (0.60) | ALDH1A1KDM4EMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5385922-A | Cardiovascular and gastrointestinal disorders; antiischemic and cardiotonic agents | CEDONA PHARMACEUTICALS B.V. (NL) | 1995-01-31 | — | — | US | disclosed |
| EP-0547104-A1 | THIAZOLIDIN DERIVATIVES | CEDONA PHARMACEUTICALS B.V. (NL) | 1993-06-23 | — | — | EP | disclosed |
| WO-1992004337-A1 | THIAZOLIDIN DERIVATIVES | CEDONA PHARMACEUTICALS BV (NL) | 1992-03-19 | — | — | WO | disclosed |