Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 15/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5625761 | 0.89 | PSEN1 (0.40) | TACR1TLR8GPBAR1 | |
| SCHEMBL27902017 | 0.81 | TACR1 (0.41) | TACR1GPBAR1 | |
| SCHEMBL14602920 | 0.81 | CETP (0.42) | TACR1TLR8GPBAR1 | |
| SCHEMBL16743080 | 0.77 | CETP (0.39) | TACR1TLR8GPBAR1 | |
| SCHEMBL14641325 | 0.74 | CETP (0.45) | TACR1GPBAR1 | |
| SCHEMBL13673129 | 0.72 | TACR1 (0.48) | TACR1 | |
| SCHEMBL5624217 | 0.71 | TACR1 (0.38) | TACR1GPBAR1 | |
| SCHEMBL7959904 | 0.71 | TACR1 (0.49) | TACR1 | |
| SCHEMBL5626325 | 0.70 | TACR1 (0.35) | TACR1TLR8GPBAR1 | |
| SCHEMBL168398 | 0.70 | TLR8 (0.69) | TLR8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103102303-B | As the benzyl amine derivative of CETP inhibitor | DR. REDDY'S LABORATORIES LTD. (IN) | 2015-10-28 | — | — | CN | disclosed |