Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | THPO | P40225 | 1/20 | 0.65 |
| ▸ | HTR1A | P08908 | 5/20 | 0.57 |
| ▸ | HTR7 | P34969 | 3/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MPO | P05164 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | HTR1B | P28222 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559641 | 0.97 | CYP1A2 (0.63) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8559411 | 0.94 | HTR1A (0.61) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8559023 | 0.91 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8558241 | 0.91 | HTR1A (0.69) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8556970 | 0.91 | ADRA1D (0.60) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8558927 | 0.91 | ADRA1D (0.63) | CYP1A2CYP3A4CYP2C9HTR1ASLC6A4 | |
| SCHEMBL8553229 | 0.88 | HTR1A (0.64) | HTR1AHTR7SLC6A4DRD2HTR2A | |
| SCHEMBL7533736 | 0.87 | CYP1A2 (0.62) | CYP1A2CYP3A4CYP2C9CYP2D6THPO | |
| SCHEMBL8557344 | 0.86 | HTR1A (0.76) | HTR1AHTR7SLC6A4KCNH2MPO | |
| SCHEMBL8554831 | 0.85 | HTR7 (0.61) | HTR1AHTR7SLC6A4KCNH2DRD2 |
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-0683166-B1 | 3-Indolylpiperidines | MERCK PATENT GMBH (DE) | 1998-10-28 | — | — | EP | disclosed |
| EP-0683166-A1 | 3-Indolylpiperidines | MERCK PATENT GmbH (DE) | 1995-11-22 | — | — | EP | disclosed |