Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 5/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | RBP4 | P02753 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8717917 | 0.95 | KDM1A (0.34) | KDM1ACNR2RIPK1HTR2CDRD2 | |
| SCHEMBL8713342 | 0.93 | DRD2 (0.34) | NPY1RDRD2HTR1ADRD4DRD3 | |
| SCHEMBL8713886 | 0.88 | HTR1A (0.34) | HTR2CDRD2HTR1ADRD4DRD3 | |
| SCHEMBL8712463 | 0.86 | GPR119 (0.43) | — | |
| SCHEMBL7871606 | 0.81 | GPR119 (0.45) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8716168 | 0.80 | NPY1R (0.40) | NPY1R | |
| SCHEMBL8718329 | 0.78 | ALDH1A1 (0.33) | CNR2DRD2HTR1AALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL7872294 | 0.77 | ALDH1A1 (0.33) | CNR2DRD2HTR1AALDH1A1TSHR | |
| SCHEMBL7868688 | 0.77 | ALDH1A1 (0.37) | DRD2HTR1ADRD4ALDH1A1 | |
| SCHEMBL7868708 | 0.76 | GPR119 (0.43) | — |
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-0826686-A2 | Tricyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-04 | — | — | EP | disclosed |