Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.70 |
| ▸ | HTR2A | P28223 | 5/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.70 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.70 |
| ▸ | DRD2 | P14416 | 4/20 | 0.70 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.70 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.70 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.70 |
| ▸ | HTR2C | P28335 | 4/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.70 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.70 |
| ▸ | HRH1 | P35367 | 4/20 | 0.70 |
| ▸ | DRD3 | P35462 | 4/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.70 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.70 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.70 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.70 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.70 |
| ▸ | HTR2B | P41595 | 3/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL22748114 | 1.00 | SLC6A2 (0.70) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| SCHEMBL29460460 | 0.96 | SLC6A2 (0.76) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| SCHEMBL29485933 | 0.96 | SLC6A2 (0.76) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| SCHEMBL11384662 | 0.96 | SLC6A2 (0.76) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Hydrochloric Acid SCHEMBL11385631 | 0.95 | SLC6A2 (0.77) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Clomipramine SCHEMBL9937630 | 0.88 | SLC6A4 (0.84) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Clomipramine SCHEMBL7402513 | 0.88 | SLC6A4 (0.84) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Hydrochloric Acid SCHEMBL22748863 | 0.83 | SLC6A2 (0.50) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Hydrochloric Acid SCHEMBL29485948 | 0.83 | SLC6A2 (0.50) | SLC6A2HTR2ACYP3A4CHRM1DRD2 | |
| Desipramine SCHEMBL34384 | 0.83 | SLC6A4 (1.00) | SLC6A2HTR2ACYP3A4CHRM1DRD2 |
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-3976185-B1 | HECT E3 LIGASE INHIBITORS AND USES THEREOF | IFOM ST FONDAZIONE DI ONCOLOGIA MOLECOLARE ETS (IT) | 2024-02-14 | — | — | EP | disclosed |
| EP-3976185-A1 | HECT E3 LIGASE INHIBITORS AND USES THEREOF | IFOM - Fondazione Istituto FIRC di Oncologia Molecolare (IT) | 2022-04-06 | — | — | EP | disclosed |