Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 2/20 | 0.42 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9509022 | 0.97 | RAB9A (0.49) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9511366 | 0.96 | RAB9A (0.44) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9508782 | 0.93 | RAB9A (0.46) | RAB9AHRH3CYP2C9NPC1ACACB | |
| SCHEMBL9512374 | 0.92 | ACACB (0.46) | RAB9AHRH3CYP2C9ACACBMAOA | |
| SCHEMBL9743688 | 0.92 | RAB9A (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9743678 | 0.92 | RAB9A (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9744280 | 0.91 | S1PR3 (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9744270 | 0.91 | S1PR3 (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9743427 | 0.91 | S1PR3 (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 | |
| SCHEMBL9743422 | 0.91 | S1PR3 (0.41) | RAB9ALMNAS1PR3HRH3CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |