Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 10/20 | 0.46 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 2/20 | 0.33 |
| ▸ | BRAF | P15056 | 2/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8720792 | 0.79 | TACR1 (0.43) | TACR1RAF1BRAFDDB1CRBN | |
| SCHEMBL8201877 | 0.79 | TACR1 (0.43) | TACR1RAF1BRAFDDB1CRBN | |
| SCHEMBL8718133 | 0.75 | TACR1 (0.38) | TACR1CHRM4CETP | |
| SCHEMBL8204411 | 0.75 | TACR1 (0.38) | TACR1CHRM4CETP | |
| SCHEMBL8202011 | 0.72 | TACR1 (0.36) | TACR1 | |
| SCHEMBL8202155 | 0.69 | TACR1 (0.43) | TACR1DDB1CRBNCETP | |
| SCHEMBL8717928 | 0.66 | TACR1 (0.40) | TACR1 | |
| SCHEMBL8720765 | 0.66 | TACR1 (0.36) | TACR1 | |
| SCHEMBL8709737 | 0.66 | TACR1 (0.35) | TACR1 | |
| SCHEMBL8201847 | 0.65 | TACR1 (0.38) | TACR1CETP |
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-0880529-A1 | SPIRO-KETAL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 1998-12-02 | — | — | EP | claimed |
| WO-1997030056-A1 | SPIRO-KETAL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 1997-08-21 | — | — | WO | claimed |