Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CCR2 | P41597 | 11/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL14814662 | 1.00 | MEN1 (0.49) | MEN1KMT2ACCR2KCNH2DRD4 | |
| SCHEMBL14833315 | 0.88 | MEN1 (0.49) | MEN1KMT2ACCR2KCNH2DRD4 | |
| SCHEMBL14815236 | 0.88 | MEN1 (0.49) | MEN1KMT2ACCR2KCNH2DRD4 | |
| SCHEMBL14815069 | 0.88 | CCR2 (0.54) | MEN1KMT2ACCR2KCNH2HPGD | |
| SCHEMBL14833216 | 0.88 | CCR2 (0.54) | MEN1KMT2ACCR2KCNH2HPGD | |
| SCHEMBL14815282 | 0.86 | HSD11B1 (0.53) | MEN1KMT2ACCR2KCNH2HPGD | |
| SCHEMBL14833207 | 0.86 | HSD11B1 (0.53) | MEN1KMT2ACCR2KCNH2HPGD | |
| SCHEMBL14814550 | 0.85 | KMT2A (0.50) | MEN1KMT2ACCR2HPGDHSD11B1 | |
| SCHEMBL14830396 | 0.85 | KMT2A (0.50) | MEN1KMT2ACCR2HPGDHSD11B1 | |
| SCHEMBL14815167 | 0.85 | KMT2A (0.50) | MEN1KMT2ACCR2HPGDHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013049164-A1 | SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS | ABBVIE INC. (US) | 2013-04-04 | — | — | WO | claimed |
| WO-2013049164-A1 | SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS | ABBVIE INC. (US) | 2013-04-04 | — | — | WO | disclosed |