Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | GPR3 | P46089 | 3/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL598133 | 1.00 | HPRT1 (0.47) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL28569273 | 1.00 | HPRT1 (0.47) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL5482727 | 0.86 | HSD17B10 (0.55) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL415471 | 0.86 | ALDH1A1 (0.55) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| Triphenylene SCHEMBL25597 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL30977781 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| Triphenylene SCHEMBL311118 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL31467394 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL1006251 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| Triphenylene SCHEMBL29363356 | 0.85 | HPRT1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1240272-A2 | A NEW FAMILY OF CONDUCTING LIQUID CRYSTALS | THE UNIVERSITY OF LEEDS (GB) | 2002-09-18 | — | — | EP | disclosed |
| WO-2001042391-A2 | A NEW FAMILY OF CONDUCTING LIQUID CRYSTALS | UNIVERSITY OF LEEDS (GB) | 2001-06-14 | — | — | WO | disclosed |