Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.40 |
| ▸ | DRD5 | P21918 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16624021 | 0.88 | HRH3 (0.51) | HRH3ESR1ESR2ABHD6DRD1 | |
| SCHEMBL16624096 | 0.84 | ACACB (0.49) | HRH3ESR1ESR2ABHD6DRD1 | |
| SCHEMBL29557542 | 0.83 | DRD1 (0.57) | HRH3ESR1ESR2ABHD6DRD1 | |
| SCHEMBL13521646 | 0.83 | DRD1 (0.57) | HRH3ESR1ESR2ABHD6DRD1 | |
| SCHEMBL18034962 | 0.82 | DRD1 (0.60) | HRH3ESR1ESR2DRD1DRD5 | |
| SCHEMBL18033539 | 0.79 | HRH3 (0.58) | HRH3MEN1ALDH1A1LMNAMAPT | |
| SCHEMBL18033523 | 0.78 | HRH3 (0.48) | HRH3ESR1ESR2ABHD6DRD1 | |
| SCHEMBL16624033 | 0.78 | HRH3 (0.47) | HRH3ESR1ESR2ABHD6DRD2 | |
| SCHEMBL16624027 | 0.78 | HRH3 (0.54) | HRH3ESR1ESR2ABHD6ACACB | |
| SCHEMBL4320078 | 0.77 | HRH3 (0.59) | HRH3ESR1ESR2DRD1DRD5 |
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-3053917-A1 | T-TYPE CALCIUM CHANNEL BLOCKER | Nissan Chemical Industries, Ltd. (JP) | 2016-08-10 | — | — | EP | disclosed |
| WO-2015050212-A1 | T-TYPE CALCIUM CHANNEL BLOCKER | 日産化学工業株式会社 | 2015-04-09 | — | — | WO | disclosed |