Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9159174 | 1.00 | RAB9A (0.41) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9158847 | 0.98 | SPHK1 (0.40) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9766712 | 0.98 | SPHK1 (0.40) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9158838 | 0.98 | SPHK1 (0.40) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9160937 | 0.95 | ACACB (0.38) | RAB9ACYP2C9HRH3MAPTL3MBTL1 | |
| SCHEMBL9160931 | 0.95 | ACACB (0.38) | RAB9ACYP2C9HRH3MAPTL3MBTL1 | |
| SCHEMBL9875481 | 0.95 | RAB9A (0.38) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9875473 | 0.95 | RAB9A (0.38) | RAB9ACYP2C9HRH3SPHK1MAPT | |
| SCHEMBL9158454 | 0.91 | MAPT (0.38) | RAB9ACYP2C9MAPTL3MBTL1MEN1 | |
| SCHEMBL9158447 | 0.91 | MAPT (0.38) | RAB9ACYP2C9MAPTL3MBTL1MEN1 |
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-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |