Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1S | Q13698 | 8/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.57 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.57 |
| ▸ | HRH2 | P25021 | 2/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.57 |
| ▸ | SCN1A | P35498 | 2/20 | 0.57 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.57 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.57 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.57 |
| ▸ | SCN4A | P35499 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.57 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.57 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.57 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL7330718 | 1.00 | CACNA1S (0.80) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7326309 | 1.00 | CACNA1S (0.80) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7326317 | 1.00 | CACNA1S (0.80) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7331055 | 0.89 | CACNA1S (1.00) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7330008 | 0.89 | CACNA1S (1.00) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7330003 | 0.89 | CACNA1S (1.00) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7329998 | 0.89 | CACNA1S (1.00) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL7331039 | 0.89 | CACNA1S (1.00) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL9506823 | 0.87 | CACNA1S (0.62) | CACNA1SCYP3A4TSHRKCNH2ABCB11 | |
| SCHEMBL22512416 | 0.81 | CACNA1S (0.84) | CACNA1SCYP3A4TSHRKCNH2ABCB11 |
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 |
|---|---|---|---|---|---|---|---|
| US-4694002-A | Benzothiazepine derivatives | E. R. SQUIBB & SONS, INC. (US) | 1987-09-15 | — | — | US | claimed |
| US-4694002-A | Benzothiazepine derivatives | E. R. SQUIBB & SONS, INC. (US) | 1987-09-15 | — | — | US | disclosed |