Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 10/20 | 0.34 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.31 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | CETP | P11597 | 1/20 | 0.30 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19188648 | 0.97 | TACR1 (0.34) | TACR1GPBAR1SIGMAR1CETPTRPM8 | |
| SCHEMBL19188494 | 0.93 | TACR1 (0.34) | TACR1GPBAR1BACE1SIGMAR1CETP | |
| SCHEMBL5624904 | 0.90 | GPBAR1 (0.35) | TACR1GPBAR1BACE1BCHEACHE | |
| SCHEMBL19188677 | 0.89 | GPBAR1 (0.35) | TACR1GPBAR1BACE1BCHEACHE | |
| SCHEMBL14602924 | 0.89 | GPBAR1 (0.38) | TACR1GPBAR1BACE1CETPTRPM8 | |
| SCHEMBL19189353 | 0.88 | TACR1 (0.34) | TACR1GPBAR1BACE1SGMS1SGMS2 | |
| SCHEMBL16743088 | 0.85 | CRHR1 (0.33) | TACR1GPBAR1BACE1BCHEACHE | |
| SCHEMBL5623760 | 0.85 | GPBAR1 (0.34) | TACR1GPBAR1BACE1BCHEACHE | |
| SCHEMBL19188694 | 0.85 | TACR1 (0.34) | TACR1GPBAR1BACE1SGMS1SGMS2 | |
| SCHEMBL19189308 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1848430-B1 | NOVEL BENZYLAMINE DERIVATIVES AS CETP INHIBITORS | Dr Reddys Laboratories Ltd (IN) | 2017-08-02 | — | — | EP | disclosed |