Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1S | Q13698 | 8/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | SCN1A | P35498 | 2/20 | 0.40 |
| ▸ | SCN4A | P35499 | 2/20 | 0.40 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.40 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | GHSR | Q92847 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10580922 | 0.86 | CACNA1S (0.44) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Bromide SCHEMBL9505829 | 0.83 | CACNA1S (0.57) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| SCHEMBL9503765 | 0.83 | CACNA1S (0.60) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Hydrochloric Acid SCHEMBL9506837 | 0.82 | ITGB2 (0.48) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Hydrochloric Acid SCHEMBL9505201 | 0.80 | ITGB2 (0.52) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| SCHEMBL10803546 | 0.79 | ITGB2 (0.44) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Hydrochloric Acid SCHEMBL9506781 | 0.79 | ITGB2 (0.46) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| SCHEMBL9506817 | 0.78 | CACNA1S (0.53) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Hydrochloric Acid SCHEMBL9504966 | 0.78 | CACNA1S (0.51) | CACNA1SCYP3A4LMNAABCB11KCNH2 | |
| Hydrochloric Acid SCHEMBL10583058 | 0.76 | LMNA (0.52) | CACNA1SCYP3A4LMNAABCB11KCNH2 |
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-0279425-B1 | USE OF BENZOTHIAZEPINE DERIVATIVES, IN PARTICULAR DILTIAZEM, IN THE MANUFACTURE OF MEDICAMENTS TO PROTECT LYMPHOCYTES | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1993-08-04 | — | — | EP | disclosed |
| EP-0279425-A2 | Use of benzothiazepine derivatives, in particular diltiazem, in the manufacture of medicaments to protect lymphocytes | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1988-08-24 | — | — | EP | disclosed |