Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 8/20 | 0.41 |
| ▸ | DRD2 | P14416 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8910312 | 0.81 | DRD4 (0.41) | CES2BCHECES1MEN1KMT2A | |
| SCHEMBL8910768 | 0.78 | DRD4 (0.39) | CES2BCHECES1MEN1KMT2A | |
| SCHEMBL28154336 | 0.74 | CES2 (0.51) | CES2BCHECES1MEN1KMT2A | |
| SCHEMBL27494865 | 0.74 | FNTA (0.44) | DRD4DRD2TP53HTR6FNTA | |
| SCHEMBL28153014 | 0.73 | CES2 (0.50) | CES2BCHECES1MEN1KMT2A | |
| SCHEMBL8911389 | 0.70 | TSHR (0.36) | ALDH1A1MAPTDRD4DRD2TP53 | |
| SCHEMBL3968052 | 0.69 | HTR6 (0.36) | MEN1KMT2AALDH1A1MAPTDRD4 | |
| SCHEMBL8880327 | 0.66 | SMN1; SMN2 (0.42) | MEN1KMT2AALDH1A1DRD4DRD2 | |
| SCHEMBL1136422 | 0.66 | HTR6 (0.46) | MEN1KMT2ADRD4DRD2TP53 | |
| SCHEMBL4597182 | 0.65 | SCN9A (0.64) | KMT2AALDH1A1TP53TSHRSCN9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000076981-A1 | PIPERIDINYL AND PIPERAZINYL SUBSTITUTED BENZOFUSED LACTAMS | NEUROGEN CORPORATION (US) | 2000-12-21 | — | — | WO | disclosed |