Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 9/20 | 0.44 |
| ▸ | HTR2A | P28223 | 6/20 | 0.44 |
| ▸ | HTR2C | P28335 | 4/20 | 0.44 |
| ▸ | HTR2B | P41595 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10044917 | 0.84 | HRH1 (0.51) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| SCHEMBL1683061 | 0.75 | HRH1 (0.48) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| SCHEMBL5739203 | 0.73 | BRD4 (0.45) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| SCHEMBL3726191 | 0.72 | HTR2A (0.39) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| Hydrochloric Acid SCHEMBL10369856 | 0.72 | BRD4 (0.44) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| SCHEMBL3727605 | 0.71 | HTR2A (0.39) | HRH1HTR2AHTR2CHTR2BCYP1A2 | |
| SCHEMBL13048440 | 0.71 | HTR2A (0.39) | HRH1HTR2AHTR2CHTR2BCYP1A2 | |
| SCHEMBL14034394 | 0.70 | HTR2A (0.41) | HTR2ACYP1A2BCHECES1RXFP1 | |
| SCHEMBL10369902 | 0.68 | HRH1 (0.40) | HRH1HTR2AHTR2CHTR2BADRA1A | |
| SCHEMBL3733684 | 0.68 | HTR2A (0.39) | HRH1HTR2AHTR2CHTR2BCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010142652-A1 | IMIDAZOBENZAZEPINE COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM (CNS) DISEASES | GLAXO GROUP LIMITED (GB) | 2010-12-16 | — | — | WO | disclosed |
| WO-2010142652-A1 | IMIDAZOBENZAZEPINE COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM (CNS) DISEASES | GLAXO GROUP LIMITED (GB) | 2010-12-16 | — | — | WO | disclosed |