Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 16/20 | 0.58 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.57 |
| ▸ | CTSS | P25774 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP8 | P22894 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8193543 | 0.97 | TACR2 (0.62) | TACR2CACNA1BMMP2MMP9MMP8 | |
| SCHEMBL7374811 | 0.93 | TACR2 (0.58) | TACR2CACNA1BMMP2MMP9MMP8 | |
| SCHEMBL7342593 | 0.88 | TACR2 (0.58) | TACR2CACNA1BCTSS | |
| SCHEMBL7368981 | 0.88 | CACNA1B (0.58) | TACR2CACNA1BCTSSMMP2MMP9 | |
| SCHEMBL7344537 | 0.87 | TACR2 (0.64) | TACR2MMP2MMP9MMP8 | |
| SCHEMBL7345251 | 0.87 | TACR2 (0.60) | TACR2CACNA1BCTSSMMP2MMP9 | |
| SCHEMBL7405881 | 0.85 | CACNA1B (0.58) | TACR2CACNA1B | |
| SCHEMBL7408901 | 0.85 | TACR2 (0.54) | TACR2CACNA1BCTSSMMP2MMP9 | |
| SCHEMBL7499275 | 0.85 | CACNA1B (0.55) | TACR2CACNA1BMMP2MMP9MMP8 | |
| SCHEMBL7345872 | 0.85 | CTSS (0.55) | TACR2CTSS |
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-6117841-A | USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY | WARNER-LAMBERT COMPANY (US) | 2000-09-12 | — | — | US | disclosed |
| WO-1998054123-A1 | SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS | WARNER-LAMBERT COMPANY (US) | 1998-12-03 | — | — | WO | disclosed |