Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 7/20 | 0.51 |
| ▸ | CTSL | P07711 | 2/20 | 0.51 |
| ▸ | CTSS | P25774 | 2/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.45 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL3499718 | 0.81 | CA1 (0.54) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL10800638 | 0.81 | CA1 (0.54) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL19227630 | 0.81 | CA1 (0.58) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL902049 | 0.81 | CA1 (0.58) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL19021911 | 0.81 | CA1 (0.58) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL8268764 | 0.81 | CA1 (0.49) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL4597828 | 0.81 | CA1 (0.58) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL19790304 | 0.80 | CA1 (0.53) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL14923535 | 0.80 | CA1 (0.53) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL25465070 | 0.79 | CA1 (0.61) | CA1CA2CA7CTSKCTSL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007075524-A2 | SUBSTITUTED PIPERIDINES AS CALCIUM CHANNEL BLOCKERS | MERCK & CO., INC. (US) | 2007-07-05 | — | — | WO | disclosed |