Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.54 |
| ▸ | HTR1A | P08908 | 2/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | HTR6 | P50406 | 9/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 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 | |
|---|---|---|---|---|
| SCHEMBL28042823 | 0.90 | SLC6A4 (0.66) | SLC6A4HTR1ASLC6A2SLC6A3HTR6 | |
| Tert-Butyl Formate SCHEMBL28042674 | 0.84 | HTR1A (0.54) | SLC6A4HTR1ASLC6A2SLC6A3HTR6 | |
| Tert-Butyl Formate SCHEMBL28042825 | 0.83 | NCF1 (0.45) | HTR1ASLC6A2HTR6HTR2CADRB2 | |
| Tert-Butyl Formate SCHEMBL27648778 | 0.80 | NCF1 (0.45) | HTR1AHTR6HTR2CADRB2NCF1 | |
| Tert-Butyl Formate SCHEMBL28761806 | 0.79 | NCF1 (0.44) | HTR1AHTR6HTR2CADRB2NCF1 | |
| Tert-Butyl Formate SCHEMBL27637688 | 0.78 | HTR1A (0.47) | SLC6A4HTR1ASLC6A2SLC6A3HTR6 | |
| Tert-Butyl Formate SCHEMBL28302827 | 0.78 | ALDH1A1 (0.52) | HTR1AHTR6HTR2CADRB2NCF1 | |
| Tert-Butyl Formate SCHEMBL28042829 | 0.78 | ADRB2 (0.44) | HTR1AHTR6HTR2CADRB2NCF1 | |
| SCHEMBL5043732 | 0.76 | ADRB2 (0.49) | SLC6A4HTR1ASLC6A2SLC6A3HTR6 | |
| SCHEMBL28042821 | 0.75 | RXRA (0.46) | SLC6A4HTR2CHTR2BRXRARXRB |
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-105461635-A | Phenylpiperazine derivatives, using method thereof and uses of the derivatives | RUYUAN YAO AUTONOMOUS COUNTY DAZHONG MEDICINE TRADE CO LTD | 2016-04-06 | — | — | CN | disclosed |