Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 9/20 | 0.41 |
| ▸ | PPARA | Q07869 | 6/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | TACR2 | P21452 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4706973 | 0.87 | RORB (0.44) | RORBPTGER4RORCP2RX7 | |
| SCHEMBL4706684 | 0.87 | RORB (0.41) | RORBKCNN4DRD1HSD17B13CNR2 | |
| SCHEMBL4704941 | 0.86 | RORB (0.40) | RORBKCNN4DRD1HSD17B13CNR2 | |
| SCHEMBL4707334 | 0.86 | RORB (0.42) | RORBKCNN4DRD1KCNH2HSD17B13 | |
| SCHEMBL4759328 | 0.83 | RORB (0.43) | RORBPTGER4RORCP2RX7 | |
| SCHEMBL4705301 | 0.82 | RORB (0.42) | RORBKCNN4CYP2C9RORCP2RX7 | |
| SCHEMBL4705134 | 0.82 | RORB (0.45) | RORBRORCP2RX7 | |
| SCHEMBL4708736 | 0.82 | RORB (0.49) | RORBCYP2C9RORCP2RX7 | |
| SCHEMBL4708293 | 0.80 | RORB (0.40) | RORBRORCP2RX7 | |
| SCHEMBL4709738 | 0.77 | RORB (0.42) | RORBSLC16A3SLC16A1MCTS1RORC |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |