Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 7/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | PTGFR | P43088 | 2/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 3/20 | 0.42 |
| ▸ | TACR2 | P21452 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2402411 | 0.96 | DHODH (0.49) | DHODHPDE10ALMNATSHRCYP2D6 | |
| SCHEMBL2429278 | 0.89 | PDE10A (0.45) | DHODHPDE10ALMNATSHRCYP2D6 | |
| SCHEMBL2404468 | 0.88 | DHODH (0.63) | DHODHPDE10ALMNATSHRCYP2D6 | |
| SCHEMBL13971502 | 0.79 | DHODH (0.77) | DHODHPDE10ALMNATSHRCYP2D6 | |
| SCHEMBL14583114 | 0.78 | PDE10A (0.77) | DHODHPDE10ALMNATSHRCYP2D6 | |
| Hydrochloric Acid SCHEMBL6969111 | 0.77 | PDE10A (0.75) | DHODHPDE10ALMNATSHRCYP2D6 | |
| SCHEMBL15184746 | 0.75 | HSD17B10 (0.54) | PDE10ALMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL28048083 | 0.75 | LMNA (0.49) | DHODHPDE10ALMNATSHRCYP2C19 | |
| SCHEMBL8271391 | 0.74 | TACR3 (0.65) | DHODHPDE10ALMNATSHRTACR3 | |
| SCHEMBL4928516 | 0.74 | DHODH (0.51) | DHODHPDE10ALMNATSHRCYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2549872-A1 | TRPV4 ANTAGONISTS | GlaxoSmithKline LLC (US) | 2013-01-30 | — | — | EP | disclosed |
| WO-2011119693-A1 | TRPV4 ANTAGONISTS | GLAXOSMITHKLINE LLC (US) | 2011-09-29 | — | — | WO | disclosed |
| WO-2011119701-A1 | TRPV4 ANTAGONISTS | GLAXOSMITHKLINE LLC (US) | 2011-09-29 | — | — | WO | disclosed |