Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 16/20 | 0.38 |
| ▸ | HTR2B | P41595 | 13/20 | 0.38 |
| ▸ | HTR2A | P28223 | 9/20 | 0.38 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27828362 | 0.83 | PKM (0.34) | — | |
| Tert-Butyl Formate SCHEMBL27828434 | 0.79 | HTR2C (0.34) | HTR2CHTR2BHTR2AHTR6CYP2D6 | |
| Tert-Butyl Formate SCHEMBL28258135 | 0.72 | KDM1A (0.36) | HTR2CHTR2BHTR2A | |
| SCHEMBL1349076 | 0.71 | HDAC6 (0.45) | — | |
| SCHEMBL22489561 | 0.71 | HTR2C (0.41) | HTR2CHTR6CYP2D6 | |
| Hydrochloric Acid SCHEMBL27828365 | 0.71 | HTR2C (0.42) | HTR2CHTR2BHTR2AHTR6ADRB1 | |
| Tert-Butyl Formate SCHEMBL28018949 | 0.70 | CHRNB2 (0.41) | HTR2CHTR2BHTR2ACYP2D6SLC6A2 | |
| Tert-Butyl Formate SCHEMBL28046430 | 0.70 | HTR2C (0.49) | HTR2CHTR6 | |
| Hydrochloric Acid SCHEMBL1349704 | 0.70 | HTR2C (0.41) | HTR2CHTR2BHTR2AHTR6ADRB1 | |
| SCHEMBL28790708 | 0.69 | PDE5A (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102056902-B | Imidazolidine derivatives | HOFFMANN LA ROCHE | 2013-08-07 | — | — | CN | disclosed |
| CN-102056902-A | Imidazolidine derivatives | HOFFMANN LA ROCHE | 2011-05-11 | — | — | CN | disclosed |