Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 19/20 | 0.58 |
| ▸ | TACR1 | P25103 | 19/20 | 0.58 |
| ▸ | TACR3 | P29371 | 3/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7841995 | 1.00 | TACR2 (0.58) | TACR2TACR1TACR3HRH1 | |
| Hydrochloric Acid SCHEMBL8347560 | 0.91 | TACR2 (0.67) | TACR2TACR1TACR3HRH1 | |
| Hydrochloric Acid SCHEMBL7574957 | 0.85 | TACR1 (0.48) | TACR2TACR1TACR3 | |
| SCHEMBL8296155 | 0.81 | SLC6A2 (0.60) | TACR2TACR1TACR3 | |
| SCHEMBL8352866 | 0.80 | TACR2 (0.86) | TACR2TACR1TACR3HRH1 | |
| SCHEMBL8347309 | 0.80 | TACR1 (0.68) | TACR2TACR1TACR3 | |
| SCHEMBL7010561 | 0.80 | TACR2 (0.61) | TACR2TACR1TACR3 | |
| Hydrochloric Acid SCHEMBL6543413 | 0.79 | TACR2 (0.60) | TACR2TACR1TACR3 | |
| Hydrochloric Acid SCHEMBL8347557 | 0.76 | SLC6A2 (0.48) | TACR1 | |
| SCHEMBL8356026 | 0.75 | TACR2 (0.88) | TACR2TACR1TACR3HRH1 |
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-0946545-B1 | NOVEL CARBOXY SUBSTITUTED CYCLIC CARBOXAMIDE DERIVATIVES | AVENTIS PHARMA INC (US) | 2001-09-05 | — | — | EP | disclosed |
| US-5977139-A | Carboxysubstituted cyclic carboxamide derivatives | HOECHST MARION ROUSSEL, INC. (US) | 1999-11-02 | — | — | US | disclosed |