Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | NCF1 | P14598 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7331996 | 0.98 | SIGMAR1 (0.44) | SIGMAR1SLC6A4SLC6A2SLC6A3HTR3E | |
| SCHEMBL27836485 | 0.88 | SIGMAR1 (0.52) | SIGMAR1SLC6A4SLC6A2SLC6A3CYP1A2 | |
| SCHEMBL20339399 | 0.83 | SIGMAR1 (0.47) | SIGMAR1SLC6A2SLC6A3CYP1A2HTR1A | |
| Hydrochloric Acid SCHEMBL23360136 | 0.82 | PRKCZ (0.43) | SLC6A4CYP1A2HTR1ACYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL29862615 | 0.82 | FLT3 (0.38) | SLC6A4SLC6A2SLC6A3CYP1A2KDM4E | |
| Hydrochloric Acid SCHEMBL23360391 | 0.82 | FLT3 (0.38) | SLC6A4SLC6A2SLC6A3CYP1A2KDM4E | |
| Hydrochloric Acid SCHEMBL29862681 | 0.82 | PRKCZ (0.43) | SLC6A4CYP1A2HTR1ACYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL23360231 | 0.77 | MAPT (0.42) | SLC6A4SLC6A2SLC6A3NCF1TSHR | |
| SCHEMBL83792 | 0.77 | SLC6A4 (0.47) | SIGMAR1SLC6A4SLC6A2SLC6A3HTR1A | |
| SCHEMBL70403 | 0.77 | SLC6A2 (0.38) | SIGMAR1SLC6A4SLC6A2SLC6A3HTR2A |
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-2268631-A1 | AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF | F. Hoffmann-La Roche AG (CH) | 2011-01-05 | — | — | EP | disclosed |
| WO-2009118254-A1 | AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2009-10-01 | — | — | WO | disclosed |