Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.54 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.41 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.40 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16624034 | 0.89 | HRH3 (0.46) | HRH3CYP17A1CYP2C9CYP2C19ABHD6 | |
| SCHEMBL18033539 | 0.83 | HRH3 (0.58) | HRH3ACACB | |
| SCHEMBL18034960 | 0.82 | DRD1 (0.56) | HRH3ESR1ESR2SCN9A | |
| SCHEMBL16624096 | 0.82 | ACACB (0.49) | HRH3ACACBESR1ESR2SCN9A | |
| SCHEMBL13385116 | 0.80 | HRH3 (0.58) | HRH3 | |
| SCHEMBL16624033 | 0.79 | HRH3 (0.47) | HRH3ESR1ESR2ABHD6 | |
| SCHEMBL13521646 | 0.79 | DRD1 (0.57) | HRH3ESR1ESR2ABHD6PRMT5 | |
| SCHEMBL29557542 | 0.79 | DRD1 (0.57) | HRH3ESR1ESR2ABHD6PRMT5 | |
| SCHEMBL16624035 | 0.78 | HRH3 (0.49) | HRH3ACACBESR1ESR2ABHD6 | |
| SCHEMBL16624021 | 0.77 | HRH3 (0.51) | HRH3ACACBESR1ESR2ABHD6 |
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 |