Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 14/20 | 0.67 |
| ▸ | TACR2 | P21452 | 7/20 | 0.67 |
| ▸ | TACR3 | P29371 | 7/20 | 0.67 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL5945397 | 0.87 | TACR3 (0.77) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL5732536 | 0.84 | TACR2 (0.71) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL2373330 | 0.84 | TRPV4 (0.72) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL5945344 | 0.83 | TRPV4 (0.80) | TRPV4TACR2TACR3OPRM1 | |
| Hydrochloric Acid SCHEMBL5733490 | 0.83 | TRPV4 (0.71) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL5203642 | 0.82 | TRPV4 (0.73) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL6428018 | 0.82 | TRPV4 (0.70) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL2514030 | 0.80 | TRPV4 (0.81) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL3085502 | 0.80 | TACR2 (1.00) | TRPV4TACR2TACR3OPRM1 | |
| SCHEMBL5945431 | 0.78 | TRPV4 (0.75) | TRPV4TACR2TACR3OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6613770-B1 | Neurokinin antagonists such as 3-(4-Isopropyl-piperazin-yl-methyl)-2-phenyl-quinoline-4-carboxylic acid (1,2-dimethyl-propyl)-amide dihydrochloride, used for prophylaxis of respiratory and gastrointerstinal disorders | SMITHKLINE BEECHAM S.P.A. (IT) | 2003-09-02 | — | — | US | disclosed |