Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 7/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
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 SCHEMBL27655991 | 0.99 | HTR2A (0.42) | SLC6A4HTR2AHTR2CHTR2BSIGMAR1 | |
| SCHEMBL27655958 | 0.98 | SLC6A4 (0.43) | SLC6A4HTR2AHTR2CHTR2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL27676056 | 0.96 | HTR2A (0.42) | SLC6A4HTR2AHTR2CHTR2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL27662355 | 0.96 | HTR2A (0.42) | SLC6A4HTR2AHTR2CHTR2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL27684330 | 0.90 | HTR2A (0.40) | SLC6A4HTR2AHTR2CHTR2BSIGMAR1 | |
| Hydrochloric Acid SCHEMBL27676007 | 0.85 | MEN1 (0.47) | SLC6A4HTR2AHTR2CHTR2BCCR5 | |
| Hydrochloric Acid SCHEMBL27655953 | 0.83 | MEN1 (0.47) | SLC6A4HTR2AHTR2CHTR2BCCR5 | |
| SCHEMBL27683995 | 0.79 | HRH3 (0.47) | SLC6A4HTR2AHTR2CHTR2BCCR5 | |
| SCHEMBL27671829 | 0.75 | SOS1 (0.40) | HTR2AHTR2CHTR2BALDH1A1SLC6A3 | |
| Hydrochloric Acid SCHEMBL27671839 | 0.74 | HTR2C (0.40) | SLC6A4HTR2AHTR2CHTR2BHTR1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1972920-A | Arylalkyl piperazine derivatives for the treatment of conditions ameliorated by monoamine reuptake including vasomotor symptoms | WYETH CORP (US) | 2007-05-30 | — | — | CN | claimed |
| CN-1972920-A | Arylalkyl piperazine derivatives for the treatment of conditions ameliorated by monoamine reuptake including vasomotor symptoms | WYETH CORP (US) | 2007-05-30 | — | — | CN | disclosed |
| CN-1894226-A | Arylalkyl- and cycloalkylalkyl-piperazine derivatives and methods of their use | WYETH CORP (US) | 2007-01-10 | — | — | CN | disclosed |