Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 14/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 12/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5190868 | 0.83 | SLC6A4 (0.45) | SLC6A4SLC6A2SLC6A3KCNH2HSD11B1 | |
| SCHEMBL21590173 | 0.74 | CNR1 (0.44) | HPGDTSHRCNR1CNR2 | |
| SCHEMBL5135452 | 0.72 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3KCNH2HSD11B1 | |
| SCHEMBL5134527 | 0.72 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3KCNH2HSD11B1 | |
| SCHEMBL23228757 | 0.71 | SLC6A4 (0.49) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL5140427 | 0.70 | SLC6A4 (0.38) | SLC6A4SLC6A2SLC6A3KCNH2HSD11B1 | |
| SCHEMBL19969993 | 0.70 | CNR1 (0.41) | CNR1CNR2 | |
| SCHEMBL10107580 | 0.70 | SLC6A4 (0.64) | SLC6A4SLC6A2SLC6A3KCNH2HPGD | |
| SCHEMBL30514759 | 0.69 | TSHR (0.47) | SLC6A4SLC6A2SLC6A3KCNH2HSD11B1 | |
| SCHEMBL4291607 | 0.69 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3KCNH2HPGD |
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-1901746-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2008-03-26 | — | — | EP | disclosed |
| WO-2007002884-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |