Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 7/20 | 0.41 |
| ▸ | RARA | P10276 | 2/20 | 0.41 |
| ▸ | RARG | P13631 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | TACR2 | P21452 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9508748 | 1.00 | HSD17B10 (0.50) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9510127 | 0.99 | TSHR (0.48) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9508776 | 0.97 | HSD17B10 (0.46) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9512554 | 0.97 | HSD17B10 (0.46) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9510153 | 0.96 | HSD17B10 (0.43) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9510224 | 0.95 | TSHR (0.43) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9509124 | 0.92 | FFAR1 (0.42) | HSD17B10TSHRFFAR1 | |
| SCHEMBL9509273 | 0.90 | HSD17B10 (0.50) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9509231 | 0.90 | HSD17B10 (0.50) | HSD17B10TSHRRARBRARARARG | |
| SCHEMBL9511390 | 0.90 | FFAR1 (0.42) | HSD17B10TSHRFFAR1 |
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 |