Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.51 |
| ▸ | HTR2C | P28335 | 4/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 7/20 | 0.48 |
| ▸ | HTR1A | P08908 | 4/20 | 0.48 |
| ▸ | HTR7 | P34969 | 4/20 | 0.48 |
| ▸ | HTR2B | P41595 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | HTR5A | P47898 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 2/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL29394356 | 0.78 | ALDH1A1 (0.55) | HTR6ESR1ESR2ALDH1A1HPGD | |
| SCHEMBL6050482 | 0.78 | ALDH1A1 (0.55) | HTR6ESR1ESR2ALDH1A1HPGD | |
| SCHEMBL17510042 | 0.74 | PARP1 (0.48) | HTR2AHTR6HTR1AHTR7HTR5A | |
| SCHEMBL16795045 | 0.74 | ALDH1A1 (0.46) | HTR6ALDH1A1HPGD | |
| SCHEMBL1136514 | 0.74 | HTR6 (0.57) | HTR6 | |
| SCHEMBL10572503 | 0.74 | KDM4E (0.57) | HTR6ALDH1A1HPGD | |
| SCHEMBL14349887 | 0.71 | PDE9A (0.52) | — | |
| SCHEMBL571923 | 0.71 | HTR6 (0.42) | HTR2AHTR6HTR1AHTR7HTR5A | |
| SCHEMBL7646497 | 0.70 | HTR2A (0.46) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL8106985 | 0.69 | RAB9A (0.57) | ALDH1A1HPGD |
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-105859606-B | Indole derivatives and its preparation method and application containing piperazinyl | 沈阳药科大学 | 2019-01-29 | — | — | CN | disclosed |