Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.45 |
| ▸ | HRH2 | P25021 | 3/20 | 0.45 |
| ▸ | HRH1 | P35367 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9510023 | 0.97 | RAB9A (0.50) | RAB9AHRH3HRH2HRH1CYP2C9 | |
| SCHEMBL9512268 | 0.96 | RAB9A (0.51) | RAB9AHRH3LMNACYP2C9HPGD | |
| SCHEMBL13401992 | 0.95 | RAB9A (0.50) | RAB9AHRH3LMNACYP2C9HPGD | |
| SCHEMBL11276971 | 0.93 | RAB9A (0.53) | RAB9AHRH3HRH2HRH1LMNA | |
| SCHEMBL9511312 | 0.93 | RAB9A (0.53) | RAB9AHRH3LMNACYP2C9CYP3A4 | |
| SCHEMBL9509946 | 0.92 | HRH3 (0.44) | RAB9AHRH3HRH2HRH1MCHR1 | |
| SCHEMBL11283562 | 0.92 | RAB9A (0.52) | RAB9AHRH3LMNARARBCYP2C9 | |
| SCHEMBL11277730 | 0.92 | RAB9A (0.52) | RAB9AHRH3LMNARARBCYP2C9 | |
| SCHEMBL11274828 | 0.92 | RAB9A (0.52) | RAB9AHRH3LMNARARBCYP2C9 | |
| SCHEMBL11287135 | 0.92 | RAB9A (0.52) | RAB9AHRH3LMNARARBCYP2C9 |
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 |