Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 15/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 13/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8963464 | 0.88 | SLC6A4 (0.41) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8963594 | 0.79 | DRD2 (0.36) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| Hydrochloric Acid SCHEMBL8963562 | 0.77 | SLC6A2 (0.36) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8963972 | 0.76 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8964204 | 0.76 | SLC6A2 (0.34) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8963882 | 0.74 | SLC6A4 (0.52) | SLC6A4SLC6A2SLC6A3TACR1 | |
| SCHEMBL8963637 | 0.72 | MAPK13 (0.37) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8963679 | 0.72 | MEN1 (0.42) | SLC6A4SLC6A2 | |
| SCHEMBL8964201 | 0.72 | DRD3 (0.55) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8963745 | 0.71 | SLC6A4 (0.37) | SLC6A4SLC6A2SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5514800-A | CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA | SYNTEX PHARMACEUTICALS, LTD. (GB) | 1996-05-07 | — | — | US | disclosed |