Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | CTSC | P53634 | 1/20 | 0.47 |
| ▸ | DPP4 | P27487 | 2/20 | 0.40 |
| ▸ | FAP | Q12884 | 1/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.40 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 3/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11424125 | 0.84 | ESR1 (0.53) | SLC6A2CYP1A2CYP2C19ESR1ESR2 | |
| SCHEMBL11407228 | 0.84 | ESR1 (0.53) | SLC6A2CYP1A2CYP2C19ESR1ESR2 | |
| SCHEMBL11411311 | 0.82 | DPP4 (0.40) | SLC6A2CTSCDPP4FAPDPP8 | |
| SCHEMBL11412673 | 0.81 | EPHX1 (0.48) | SLC6A4SLC6A2SLC6A3CTSCTAAR1 | |
| SCHEMBL8690443 | 0.81 | EPHX1 (0.48) | SLC6A4SLC6A2SLC6A3CTSCTAAR1 | |
| SCHEMBL11405363 | 0.78 | SLC6A4 (0.54) | SLC6A4DPP4FAPDPP8DPP9 | |
| SCHEMBL18703964 | 0.77 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3CTSCDPP4 | |
| SCHEMBL10763436 | 0.74 | SLC6A4 (0.67) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL6357746 | 0.73 | SLC6A4 (0.53) | SLC6A4SLC6A2SLC6A3CYP2D6CYP2C19 | |
| SCHEMBL5812524 | 0.73 | SLC6A4 (0.53) | SLC6A4SLC6A2SLC6A3CYP2D6CYP2C19 |
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-4240975-A | USED AS ENZYME INHIBITOR, ANTIFERTILITY AGENT, AND ENHANCES THE ANTITUMOR EFFECT OF BLEOMYCIN | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1980-12-23 | — | — | US | disclosed |
| US-4189604-A | PEPTIDASE ENZYME INHIBITORS | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1980-02-19 | — | — | US | disclosed |