Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.46 |
| ▸ | HTR1D | P28221 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.45 |
| ▸ | NCF1 | P14598 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | IDH2 | P48735 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5936567 | 0.86 | HTR1A (0.44) | HTR3AHTR1DHTR2CHTR1ACYP1A2 | |
| SCHEMBL5560257 | 0.84 | ADRB2 (0.43) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL5936594 | 0.84 | NCF1 (0.41) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL5936593 | 0.84 | HTR1A (0.46) | HTR3AHTR2CADRB2HTR1AADRB1 | |
| SCHEMBL4202572 | 0.84 | CYP1A2 (0.55) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL6029951 | 0.83 | HTR1A (0.44) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL6030820 | 0.83 | DRD2 (0.45) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL4331521 | 0.83 | HTR3A (0.40) | HTR3AHTR1DHTR2CHTR3EHTR3B | |
| SCHEMBL5936575 | 0.82 | HTR1A (0.47) | HTR3AHTR1DHTR2CNCF1HTR1A | |
| SCHEMBL4428815 | 0.81 | ADRB1 (0.41) | HTR3AHTR1DHTR2CHTR3EHTR3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1696931-A2 | AMINO SUBSTITUTED DIARYL [A,D]CYCLOHEPTENE ANALOGS AS MUSCARINIC AGONISTS AND METHODS OF TREATMENT OF NEUROPSYCHIATRIC DISORDERS | Acadia Pharmaceuticals Inc. (US) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005063254-A2 | AMINO SUBSTITUTED DIARYL[A,D]CYCLOHEPTENE ANALOGS AS MUSCARINIC AGONISTS AND METHODS OF TREATMENT OF NEUROPSYCHIATRIC DISORDERS | ACADIA PHARMACEUTICALS INC. (US) | 2005-07-14 | — | — | WO | disclosed |