Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 3/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 15/20 | 0.38 |
| ▸ | TACR2 | P21452 | 2/20 | 0.38 |
| ▸ | TACR3 | P29371 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7166157 | 0.94 | DHODH (0.50) | DHODHTRPV4TACR2TACR3OPRM1 | |
| SCHEMBL6586109 | 0.91 | TRPV4 (0.43) | DHODHTRPV4TACR2TACR3OPRM1 | |
| SCHEMBL7159967 | 0.89 | DHODH (0.46) | DHODHTACR2TACR3OPRM1 | |
| SCHEMBL6340547 | 0.88 | TACR3 (0.40) | DHODHTACR2TACR3OPRM1KCNH2 | |
| SCHEMBL6951612 | 0.87 | TACR3 (0.47) | DHODHTACR2TACR3OPRM1KCNH2 | |
| SCHEMBL7076610 | 0.87 | DHODH (0.48) | DHODHTACR2TACR3OPRM1KCNH2 | |
| Hydrochloric Acid SCHEMBL7077944 | 0.86 | TACR3 (0.47) | DHODHTACR2TACR3OPRM1KCNH2 | |
| SCHEMBL14480370 | 0.86 | TRPV4 (0.40) | TRPV4TACR2TACR3NR1I2KCNH2 | |
| SCHEMBL7165599 | 0.85 | TACR3 (0.43) | DHODHTRPV4TACR2TACR3OPRM1 | |
| SCHEMBL6956361 | 0.84 | TACR3 (0.38) | DHODHTRPV4TACR2TACR3OPRM1 |
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-1339691-A1 | NOVEL COMPOUNDS | GlaxoSmithKline S.p.A. (IT) | 2003-09-03 | — | — | EP | disclosed |
| WO-2002044154-A1 | NOVEL COMPOUNDS | GLAXOSMITHKLINE SPA (IT) | 2002-06-06 | — | — | WO | disclosed |