Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21607408 | 1.00 | HCRTR2 (0.39) | HCRTR2EPHX1HTTGAATDP1 | |
| SCHEMBL21607705 | 1.00 | HCRTR2 (0.39) | HCRTR2EPHX1HTTGAATDP1 | |
| SCHEMBL28532985 | 1.00 | HCRTR2 (0.39) | HCRTR2EPHX1HTTGAATDP1 | |
| SCHEMBL21607699 | 1.00 | HCRTR2 (0.39) | HCRTR2EPHX1HTTGAATDP1 | |
| SCHEMBL28532960 | 0.86 | HCRTR2 (0.38) | HCRTR2EPHX1HTTGAATDP1 | |
| SCHEMBL28458597 | 0.84 | HCRTR2 (0.41) | HCRTR2EPHX1GAATDP1DRD2 | |
| SCHEMBL21607282 | 0.84 | HCRTR2 (0.41) | HCRTR2EPHX1GAATDP1DRD2 | |
| SCHEMBL23189919 | 0.81 | SMN1; SMN2 (0.34) | HTTKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL8286393 | 0.81 | DRD2 (0.39) | HCRTR2EPHX1TDP1DRD2KMT2A | |
| SCHEMBL28662052 | 0.81 | HCRTR2 (0.45) | HCRTR2EPHX1HTTTDP1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019243999-A1 | PHENYL SUBSTITUTED PYRAZOLES AS MODULATORS OF RORYT | JANSSEN PHARMACEUTICA NV (BE) | 2019-12-26 | — | — | WO | disclosed |