Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 4/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | IDE | P14735 | 1/20 | 0.41 |
| ▸ | UBE2N | P61088 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11383597 | 0.88 | HTR1A (0.47) | HTR1AHTR2CHTR3EHTR3BALDH1A1 | |
| SCHEMBL6031383 | 0.82 | MITF (0.49) | HTR1AHTR2CHTR3EHTR3BALDH1A1 | |
| SCHEMBL10758926 | 0.81 | HDAC1 (0.42) | HTR1AHTR2CSIGMAR1MITF | |
| SCHEMBL4977025 | 0.80 | SLC18A3 (0.44) | HTR2CMITFHTR2AHTR2B | |
| SCHEMBL10763366 | 0.79 | ALDH1A1 (0.48) | ALDH1A1DRD2MAPT | |
| SCHEMBL2384221 | 0.76 | HTR1A (0.47) | HTR1AHTR2CHTR3EHTR3BALDH1A1 | |
| SCHEMBL11376776 | 0.76 | HTR1A (0.47) | HTR1AHTR2CHTR3EHTR3BALDH1A1 | |
| Hydrochloric Acid SCHEMBL11384536 | 0.75 | HTR2C (0.47) | HTR1AHTR2CHTR3EHTR3BALDH1A1 | |
| SCHEMBL8781530 | 0.75 | NPC1 (0.40) | HTR1AL3MBTL1 | |
| SCHEMBL1667741 | 0.74 | SLC18A3 (0.33) | HTR2CHTR2AHTR2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114085197-B | Synthesis method of 4- (3-trifluoromethyl phenyl) -1-piperazine-ethanol, flibanserin intermediate and flibanserin | 合肥创新医药技术有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-114085197-A | Synthesis method of 4- (3-trifluoromethylphenyl) -1-piperazine-ethanol, flibanserin intermediate and flibanserin | 合肥创新医药技术有限公司 | 2022-02-25 | — | — | CN | disclosed |
| EP-0008256-A2 | Indane-acetic acid esters, their preparation and medicaments containing them | HEXACHIMIE Société anonyme dite: (FR) | 1980-02-20 | — | — | EP | disclosed |
| US-4096260-A | Novel indoles | ROUSSEL UCLAF (FR) | 1978-06-20 | — | — | US | disclosed |