Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | HTR2C | P28335 | 2/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | HTR6 | P50406 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.57 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.57 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.57 |
| ▸ | DRD1 | P21728 | 1/20 | 0.57 |
| ▸ | DRD4 | P21917 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL11707407 | 0.93 | HTR2A (0.57) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL11707801 | 0.90 | HTR2A (0.58) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL11713024 | 0.89 | CYP3A4 (0.57) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| Declenperone SCHEMBL2112237 | 0.86 | HTR2A (0.69) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL11708157 | 0.86 | HTR2A (0.58) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL11707541 | 0.84 | HTR2A (0.69) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL3404250 | 0.84 | HTR2A (0.58) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| Milenperone SCHEMBL121986 | 0.83 | CYP2D6 (0.58) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| Milenperone SCHEMBL29710910 | 0.83 | CYP2D6 (0.58) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD | |
| SCHEMBL11708317 | 0.83 | HTR2A (0.64) | HTR2ACYP3A4CYP1A2ALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4035369-A | 1-Benzazolylalkyl-4-substituted-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-07-12 | — | — | US | disclosed |