Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7504954 | 0.98 | HSD17B10 (0.53) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9328426 | 0.98 | HSD17B10 (0.53) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9508953 | 0.96 | HSD17B10 (0.49) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9511358 | 0.96 | HSD17B10 (0.49) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9512241 | 0.96 | HSD17B10 (0.58) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9508948 | 0.96 | HSD17B10 (0.58) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9512216 | 0.94 | HSD17B10 (0.47) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9512353 | 0.94 | HSD17B10 (0.47) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9328415 | 0.93 | HSD17B10 (0.50) | HSD17B10TSHRCA2CA1ALDH1A1 | |
| SCHEMBL9327020 | 0.93 | HSD17B10 (0.59) | HSD17B10TSHRCA2CA1ALDH1A1 |
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 |