Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11523252 | 0.89 | HRH3 (0.39) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11523258 | 0.89 | HRH3 (0.39) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11616707 | 0.83 | GPR88 (0.41) | — | |
| SCHEMBL11617719 | 0.81 | SPHK1 (0.40) | SPHK1 | |
| SCHEMBL11617231 | 0.81 | FFAR1 (0.39) | RAB9AHRH3DRD2 | |
| SCHEMBL11617828 | 0.81 | RAB9A (0.49) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11617173 | 0.80 | RAB9A (0.48) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11622492 | 0.80 | RAB9A (0.48) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11621335 | 0.80 | RAB9A (0.48) | RAB9AHRH3CYP2C9ALDH1A1LMNA | |
| SCHEMBL11620410 | 0.80 | RAB9A (0.48) | RAB9AHRH3CYP2C9ALDH1A1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4130502-A | Liquid crystalline cyclohexane derivatives | MERCK PATENT GESELLSCHAFT MIT (DE) | 1978-12-19 | — | — | US | disclosed |