Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAOK3 | Q9H2K8 | 3/20 | 0.42 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.37 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14192555 | 0.89 | NPC1 (0.43) | TAOK3TAOK1MCHR1THRATHRB | |
| SCHEMBL14219186 | 0.80 | ALDH5A1 (0.41) | — | |
| SCHEMBL14192569 | 0.78 | S1PR1 (0.42) | CNR2THRATHRB | |
| SCHEMBL14192568 | 0.77 | THRA (0.48) | TP53TSHRTHRATHRBPLA2G4B | |
| SCHEMBL14192479 | 0.76 | ITGB3 (0.43) | TAOK3TAOK1MCHR1 | |
| SCHEMBL14192507 | 0.76 | CYP3A4 (0.46) | MCHR1CNR2THRATHRB | |
| SCHEMBL14192567 | 0.75 | RARB (0.51) | TP53TSHRTHRATHRBPLA2G4B | |
| SCHEMBL14192450 | 0.75 | RAB9A (0.47) | RAB9ATP53TSHRTHRATHRB | |
| SCHEMBL6538549 | 0.74 | TP53 (0.64) | TP53TSHRTHRATHRBPLA2G4B | |
| SCHEMBL14192446 | 0.74 | TP53 (0.47) | RAB9ATP53TSHRTHRATHRB |
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-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |