Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25882063 | 0.83 | SLC6A9 (0.50) | SLC6A9PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL327686 | 0.79 | CYP2D6 (0.43) | TSHRNPSR1KDM4ECYP2D6CYP2C9 | |
| SCHEMBL12503222 | 0.78 | CYP2D6 (0.47) | SLC6A9TSHRNPSR1KDM4ECYP2D6 | |
| SCHEMBL323778 | 0.73 | CHRM2 (0.58) | SLC6A9TSHRKDM4ECYP2D6CYP3A4 | |
| SCHEMBL324172 | 0.71 | CYP2D6 (0.67) | SLC6A9TSHRNPSR1CYP2D6CYP2C19 | |
| SCHEMBL325002 | 0.70 | ALDH1A1 (0.47) | SLC6A9TSHRNPSR1KDM4ECYP2D6 | |
| SCHEMBL25882084 | 0.68 | KDM4E (0.46) | TSHRKDM4EHRH3OPRM1OPRD1 | |
| SCHEMBL25882044 | 0.68 | KDM4E (0.46) | TSHRKDM4EHRH3OPRM1OPRD1 | |
| SCHEMBL323776 | 0.68 | CYP3A4 (0.61) | SLC6A9TSHRNPSR1CYP2D6CYP3A4 | |
| SCHEMBL325153 | 0.68 | CYP3A4 (0.48) | SLC6A9TSHRCYP2D6CYP3A4CYP2C19 |
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-2590953-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2013-05-15 | — | — | EP | claimed |
| WO-2012004604-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2012-01-12 | — | — | WO | claimed |