Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 6/20 | 0.48 |
| ▸ | HTR1A | P08908 | 4/20 | 0.45 |
| ▸ | HTR6 | P50406 | 4/20 | 0.45 |
| ▸ | HTR3A | P46098 | 3/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | HTR7 | P34969 | 3/20 | 0.45 |
| ▸ | HTR5A | P47898 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | MTOR | P42345 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.45 |
| ▸ | HTR3B | O95264 | 1/20 | 0.45 |
| ▸ | NCF1 | P14598 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9080717 | 0.95 | ADRB1 (0.44) | ADRB1HTR1AHTR6HTR3AHTR2A | |
| SCHEMBL4796942 | 0.84 | HTR1A (0.45) | ADRB1HTR1AHTR6HTR3AHTR2A | |
| SCHEMBL5936585 | 0.84 | HTR1A (0.46) | ADRB1HTR1AHTR6HTR3AHTR2A | |
| SCHEMBL5936587 | 0.84 | ADRB1 (0.42) | ADRB1HTR1AHTR6HTR3AHTR2A | |
| SCHEMBL5936566 | 0.84 | ADRB1 (0.49) | ADRB1HTR1AHTR6HTR3AHTR2A | |
| SCHEMBL3685628 | 0.83 | HRH4 (0.51) | HTR1AHTR6HTR3AHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL5606159 | 0.82 | HRH4 (0.50) | HTR1AHTR6HTR3AHTR2AHTR7 | |
| SCHEMBL5971687 | 0.80 | KDM4E (0.46) | HTR6KDM4EALDH1A1DRD2DRD3 | |
| SCHEMBL7256282 | 0.80 | HRH4 (0.45) | HTR6TSHRKDM4EALDH1A1TRPA1 | |
| SCHEMBL6029951 | 0.79 | HTR1A (0.44) | ADRB1HTR1AHTR6HTR3AHTR2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008021463-A2 | AMINO SUBSTITUTED DIARYL[A,D]CYCLOHEPTENE ANALOGS AS MUSCARINIC AGONISTS AND METHODS OF TREATMENT OF NEUROPSYCHIATRIC DISORDERS | ACADIA PHARMACEUTICALS, INC. (US) | 2008-02-21 | — | — | WO | claimed |
| WO-1996018623-A1 | BENZYL-SUBSTITUTED COMPOUNDS HAVING DOPAMINE RECEPTOR AFFINITY | ALLELIX BIOPHARMACEUTICALS INC. (US) | 1996-06-20 | — | — | WO | disclosed |
| WO-1996018621-A1 | ALKYL-SUBSTITUTED COMPOUNDS HAVING DOPAMINE RECEPTOR AFFINITY | ALLELIX BIOPHARMACEUTICALS INC. (US) | 1996-06-20 | — | — | WO | disclosed |