Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.65 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.65 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.49 |
| ▸ | AXL | P30530 | 1/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | ERN1 | O75460 | 1/20 | 0.47 |
| ▸ | KMO | O15229 | 1/20 | 0.47 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27636086 | 0.79 | ESR2 (0.61) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL12491570 | 0.79 | MKNK1 (0.60) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL30137140 | 0.79 | ESR2 (0.61) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL13890275 | 0.78 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL14715531 | 0.77 | ESR2 (0.57) | CYP2A6CYP1A2ALDH1A1MEN1 | |
| SCHEMBL21753332 | 0.76 | MKNK1 (0.54) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL25463021 | 0.75 | CYP11B1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL21770157 | 0.75 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL12103445 | 0.74 | CYP2A6 (0.79) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL17951830 | 0.74 | CYP2A6 (0.79) | MKNK1MKNK2CYP2A6CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1558567-A1 | NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2005-08-03 | — | — | EP | disclosed |
| WO-2004039764-A1 | NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2004-05-13 | — | — | WO | disclosed |