Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.48 |
| ▸ | HTR1D | P28221 | 5/20 | 0.48 |
| ▸ | HTR1B | P28222 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8544087 | 0.88 | HTR1D (0.50) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL10646261 | 0.83 | HTR1D (0.57) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL9828421 | 0.83 | HTR1D (0.67) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL9258017 | 0.82 | HRH3 (0.55) | HTR1AHTR1DHTR1BCYP1A2ALDH1A1 | |
| SCHEMBL8538117 | 0.82 | CYP1A2 (0.56) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL8539020 | 0.81 | ADRA2A (0.62) | — | |
| SCHEMBL8543448 | 0.80 | ADRA2A (0.61) | — | |
| SCHEMBL9698903 | 0.80 | MTNR1A (0.56) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL9329223 | 0.75 | SLC6A4 (0.69) | HTR1AHTR1DHTR1BCYP1A2CYP2C9 | |
| SCHEMBL12720724 | 0.73 | MTNR1A (0.52) | HTR1ACYP1A2ALDH1A1 |
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-0496222-B1 | Indole derivatives | MERCK PATENT GMBH (DE) | 1998-09-09 | — | — | EP | disclosed |
| EP-0496222-A1 | Indole derivatives | MERCK PATENT GmbH (DE) | 1992-07-29 | — | — | EP | disclosed |