Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 4/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 6/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR1E | P28566 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR5A | P47898 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | EED | O75530 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27606442 | 0.83 | HTR7 (0.68) | HTR7ACHEHTR1AHTR1DHTR1B | |
| SCHEMBL8089559 | 0.83 | TUBB1 (0.37) | HTR7 | |
| SCHEMBL28752781 | 0.81 | HRH3 (0.41) | HRH3HTR7TAAR1 | |
| SCHEMBL8081800 | 0.80 | GABRA1 (0.42) | — | |
| SCHEMBL27836349 | 0.80 | HRH3 (0.52) | HRH3HTR7TAAR1TNKSEED | |
| SCHEMBL27588548 | 0.79 | HTR7 (0.40) | HRH3HTR7TAAR1ACHETNKS | |
| SCHEMBL27588464 | 0.78 | HRH3 (0.50) | HRH3TAAR1 | |
| SCHEMBL27606406 | 0.78 | HRH3 (0.50) | HRH3TAAR1TNKS | |
| SCHEMBL27687809 | 0.78 | HRH3 (0.50) | HRH3TAAR1TNKSEED | |
| SCHEMBL9268604 | 0.77 | ABL1 (0.42) | — |
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-1553900-A | Acylsemicarbazides as cyclin dependent kinase inhibitors useful as anti-cancer and anti-proliferative agents | ��ʱ��ʩ����ҩ��˾ | 2004-12-08 | — | — | CN | disclosed |