Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.49 |
| ▸ | RELA | Q04206 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 3/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | ACR | P10323 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14088555 | 1.00 | HTT (0.50) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL14075597 | 1.00 | HTT (0.50) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL17301220 | 1.00 | HTT (0.50) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL17301205 | 1.00 | HTT (0.50) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL12650347 | 1.00 | HTT (0.50) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL10078026 | 0.99 | THRB (0.51) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL14346692 | 0.99 | THRB (0.51) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL25501125 | 0.99 | THRB (0.51) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL10078018 | 0.99 | THRB (0.51) | HTTCYP3A4ALDH1A1TSHRTHRB | |
| SCHEMBL14346684 | 0.97 | HTT (0.48) | HTTCYP3A4ALDH1A1TSHRTHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150344782-A1 | POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL AND METHOD FOR MANUFACTURING THE SAME, AND FILM | FUJIFILM CORPORATION (JP) | 2015-12-03 | — | — | US | disclosed |
| US-20150344782-A1 | POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL AND METHOD FOR MANUFACTURING THE SAME, AND FILM | FUJIFILM CORPORATION (JP) | 2015-12-03 | — | — | US | disclosed |