Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 2/20 | 0.43 |
| ▸ | NOS3 | P29474 | 6/20 | 0.41 |
| ▸ | NOS1 | P29475 | 6/20 | 0.41 |
| ▸ | NOS2 | P35228 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1F | P30939 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6789672 | 0.84 | SCD (0.55) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL2266494 | 0.81 | PRKCI (0.51) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL30594683 | 0.81 | PRKCI (0.51) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL27481026 | 0.80 | HTR1A (0.45) | SCDNOS3NOS1NOS2HTR1D | |
| SCHEMBL12367572 | 0.77 | NOS3 (0.54) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL6796534 | 0.74 | SCD (0.38) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL30271234 | 0.74 | PRKCI (0.49) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL21641745 | 0.74 | PRKCI (0.49) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL3352865 | 0.74 | HTR1D (0.51) | SCDNOS3NOS1NOS2DRD2 | |
| SCHEMBL25424302 | 0.71 | SCD (0.46) | SCDNOS3NOS1NOS2DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1154105-A | 4-aryl-1-(indanmethyl, dihydrobenzofuranmethyl or dihydrobenzothiophenemethyl) piperidines, tetrahydropyridines or piperazines | LUNDBECK & CO AS H (DK) | 1997-07-09 | — | — | CN | disclosed |