Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | DRD4 | P21917 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | DRD3 | P35462 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8871408 | 0.90 | TDP1 (0.58) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL9229535 | 0.88 | SLC6A4 (0.64) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL9581909 | 0.87 | HTR1A (0.74) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL8870806 | 0.84 | HTR1A (0.59) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL11115378 | 0.83 | HTR1A (0.56) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL8871095 | 0.82 | HTR1A (0.61) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL8871306 | 0.81 | HTR1A (0.77) | HTR1ACYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL8552552 | 0.80 | KDM4E (0.62) | HTR1ADRD2DRD4DRD3TDP1 | |
| SCHEMBL8555864 | 0.80 | KDM4E (0.62) | HTR1ADRD2DRD4DRD3TDP1 | |
| SCHEMBL8871147 | 0.79 | HTR1A (0.59) | HTR1A |
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-5693655-A | 3-indolylpiperidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-12-02 | — | — | US | disclosed |