Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | CTSA | P10619 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1237286 | 0.83 | TSHR (0.57) | TSHRALDH1A1LMNAHSD17B10PPARD | |
| SCHEMBL11122982 | 0.83 | TSHR (0.57) | TSHRALDH1A1LMNAHSD17B10PPARD | |
| SCHEMBL2239035 | 0.82 | TSHR (0.39) | TSHRGAA | |
| SCHEMBL21764725 | 0.82 | CYP3A4 (0.52) | TSHRALDH1A1 | |
| SCHEMBL28101148 | 0.81 | TSHR (0.55) | TSHRALDH1A1LMNAHSD17B10PPARD | |
| SCHEMBL3819715 | 0.81 | TSHR (0.60) | TSHRALDH1A1PPARDCTSAACHE | |
| SCHEMBL86164 | 0.81 | TSHR (0.60) | TSHRALDH1A1PPARDCTSAACHE | |
| SCHEMBL27737027 | 0.80 | TSHR (0.40) | TSHR | |
| SCHEMBL9007352 | 0.78 | TSHR (0.50) | TSHRALDH1A1LMNAHSD17B10PPARD | |
| Trimethylammonium SCHEMBL28541031 | 0.76 | TSHR (0.48) | TSHRALDH1A1LMNAHSD17B10PPARD |
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-0661271-B1 | AZEPINE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS SIGMA-RECEPTOR LIGANDS | ASAHI CHEMICAL IND (JP) | 2000-04-26 | — | — | EP | disclosed |
| EP-0661271-A1 | AZEPINE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1995-07-05 | — | — | EP | disclosed |