Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.39 |
| ▸ | ACACB | O00763 | 8/20 | 0.38 |
| ▸ | ATP4A | P20648 | 2/20 | 0.35 |
| ▸ | ATP4B | P51164 | 2/20 | 0.35 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9766659 | 0.90 | CYP2D6 (0.42) | MCHR1ACACBKDM4EALDH1A1HPGD | |
| SCHEMBL9158961 | 0.90 | NR5A1 (0.42) | ACACBNR5A1KDM4EALDH1A1HPGD | |
| SCHEMBL9154867 | 0.87 | ACACB (0.41) | ACACBHTT | |
| SCHEMBL9158222 | 0.87 | ACACB (0.40) | ACACBNR5A1KDM4EALDH1A1HPGD | |
| SCHEMBL9157229 | 0.86 | CYP2D6 (0.44) | MCHR1NR5A1KDM4EALDH1A1HPGD | |
| SCHEMBL9159722 | 0.85 | NQO1 (0.42) | ACACB | |
| SCHEMBL9157720 | 0.84 | MCHR1 (0.42) | MCHR1ACACBKDM4EALDH1A1HPGD | |
| SCHEMBL9157311 | 0.84 | CYP2D6 (0.47) | MCHR1KDM4EALDH1A1HPGDHTT | |
| SCHEMBL9159082 | 0.82 | APP (0.47) | MCHR1ACACBKDM4EALDH1A1 | |
| SCHEMBL9158464 | 0.81 | NQO1 (0.39) | MCHR1ACACBKDM4EALDH1A1HPGD |
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-0445248-A1 | PYRIDINE DERIVATIVES. | MERCK PATENT GMBH (DE) | 1991-09-11 | — | — | EP | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |