Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9160931 | 1.00 | ACACB (0.38) | ACACBRAB9AKCNH2MAPTSMN1; SMN2 | |
| SCHEMBL9159166 | 0.95 | RAB9A (0.41) | RAB9AKCNH2MAPTCYP2C9ALDH1A1 | |
| SCHEMBL9159174 | 0.95 | RAB9A (0.41) | RAB9AKCNH2MAPTCYP2C9ALDH1A1 | |
| SCHEMBL9766712 | 0.93 | SPHK1 (0.40) | RAB9AMAPTCYP2C9LMNAL3MBTL1 | |
| SCHEMBL9158847 | 0.93 | SPHK1 (0.40) | RAB9AMAPTCYP2C9LMNAL3MBTL1 | |
| SCHEMBL9158838 | 0.93 | SPHK1 (0.40) | RAB9AMAPTCYP2C9LMNAL3MBTL1 | |
| SCHEMBL9158447 | 0.91 | MAPT (0.38) | ACACBRAB9AMAPTCYP2C9ALDH1A1 | |
| SCHEMBL9158454 | 0.91 | MAPT (0.38) | ACACBRAB9AMAPTCYP2C9ALDH1A1 | |
| SCHEMBL9875473 | 0.91 | RAB9A (0.38) | RAB9AMAPTCYP2C9LMNAL3MBTL1 | |
| SCHEMBL9875481 | 0.91 | RAB9A (0.38) | RAB9AMAPTCYP2C9LMNAL3MBTL1 |
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 4 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 |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |
| 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 |