Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.60 |
| ▸ | DRD2 | P14416 | 4/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.59 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.54 |
| ▸ | APP | P05067 | 2/20 | 0.53 |
| ▸ | HTR1D | P28221 | 4/20 | 0.53 |
| ▸ | HTR1B | P28222 | 4/20 | 0.53 |
| ▸ | HTR1A | P08908 | 3/20 | 0.53 |
| ▸ | HTR1F | P30939 | 3/20 | 0.53 |
| ▸ | HTR2A | P28223 | 3/20 | 0.53 |
| ▸ | HTR7 | P34969 | 3/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | THPO | P40225 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18324840 | 0.92 | HSD11B1 (0.65) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL18324848 | 0.89 | HSD11B1 (0.57) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| Bromide SCHEMBL7870891 | 0.86 | DRD2 (0.73) | DRD2SLC6A4ADRA1DAPPHTR1D | |
| Hydrochloric Acid SCHEMBL7867314 | 0.86 | DRD2 (0.73) | DRD2SLC6A4ADRA1DAPPHTR1D | |
| SCHEMBL16802074 | 0.84 | KDM4E (0.69) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL18324838 | 0.83 | HSD11B1 (0.55) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL6184605 | 0.83 | DRD2 (0.61) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL18701706 | 0.82 | DRD2 (0.61) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL18324841 | 0.81 | DRD2 (0.60) | HSD11B1DRD2SLC6A4ADRA1DHTR1D | |
| SCHEMBL18324842 | 0.81 | DRD2 (0.66) | HSD11B1DRD2SLC6A4ADRA1DHTR1D |
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 |
|---|---|---|---|---|---|---|---|
| EP-3082802-B1 | TRYPTOPHAN-2,3-DIOXYGENASE (TDO) AND/OR INDOLAMINE-2,3-DIOXYGENASE (IDO) INHIBITORS AND THEIR USE | IOMET PHARMA LTD (GB) | 2020-02-26 | — | — | EP | disclosed |