Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.64 |
| ▸ | HTR2A | P28223 | 3/20 | 0.62 |
| ▸ | HTR2C | P28335 | 2/20 | 0.62 |
| ▸ | DRD2 | P14416 | 3/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | DRD1 | P21728 | 1/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
| ▸ | HTR1D | P28221 | 1/20 | 0.58 |
| ▸ | HTR1B | P28222 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL7285993 | 0.91 | ACHE (0.62) | ACHEHTR2AHTR2CDRD2SLC6A4 | |
| SCHEMBL10896910 | 0.85 | DRD2 (0.61) | ACHEHTR2ADRD2SLC6A4 | |
| SCHEMBL1545611 | 0.82 | ACHE (0.93) | ACHEHTR2AHTR2CDRD2SLC6A4 | |
| SCHEMBL9423869 | 0.82 | SLC18A2 (0.58) | HTR2AHTR2CDRD2SLC6A4HTR1A | |
| SCHEMBL1545272 | 0.81 | ACHE (0.63) | ACHEHTR2AHTR2CDRD2SLC6A4 | |
| SCHEMBL11244560 | 0.80 | HTR1A (0.55) | HTR2ADRD2HTR1A | |
| SCHEMBL10896514 | 0.79 | DRD2 (0.62) | ACHEDRD2SLC6A4 | |
| SCHEMBL17474575 | 0.79 | SLC18A2 (0.72) | HTR2AHTR2CDRD2SLC6A4HTR1A | |
| SCHEMBL1544931 | 0.79 | ACHE (0.71) | ACHEHTR2AHTR2CDRD2SLC6A4 | |
| Bromide SCHEMBL10894851 | 0.79 | HTR1A (0.54) | HTR2ADRD2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4804663-A | PSYCHOLOGICAL DISORDERS | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-02-14 | — | — | US | disclosed |
| EP-0196132-A2 | 1,2-Benzisoxazol-3-yl and 1,2-benzisothiazol-3-yl derivatives | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-10-01 | — | — | EP | disclosed |