Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRAP1 | Q12931 | 3/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135639 | 0.88 | AKR1B1 (0.38) | PTGDR2SMN1; SMN2AKR1B1CYP1A2MAPT | |
| SCHEMBL4259693 | 0.83 | AKR1B1 (0.41) | TRAP1HSP90AA1HSP90B1PTGDR2P2RX7 | |
| SCHEMBL4976851 | 0.78 | TRAP1 (0.39) | TRAP1HSP90AA1HSP90B1P2RX7CRHR1 | |
| SCHEMBL3957230 | 0.76 | ALDH1A1 (0.39) | PTGDR2AKR1B1CYP1A2MAPTCYP2C19 | |
| SCHEMBL2486352 | 0.74 | PTGDR2 (0.62) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL4262078 | 0.73 | HSP90AA1 (0.39) | TRAP1HSP90AA1HSP90B1PTGDR2P2RX7 | |
| SCHEMBL2484248 | 0.72 | PTGDR2 (0.64) | PTGDR2MAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL3950566 | 0.72 | AKR1B1 (0.42) | AKR1B1CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL4979296 | 0.72 | AKR1B1 (0.41) | SMN1; SMN2AKR1B1CYP1A2MAPTCYP2C19 | |
| SCHEMBL4263802 | 0.71 | AKR1B1 (0.43) | PTGDR2AKR1B1CHRM5 |
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-1984374-A1 | USE OF SPIRO Ý IMIDAZOLIDINE-4, 3'-INDOLE¨2, 2', 5' (1H) TRIONES FOR TREATMENT OF CONDITIONS ASSOCIATED WITH VANILLOID RECEPTOR 1 | AstraZeneca AB (SE) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007091946-A1 | USE OF SPIRO [ IMIDAZOLIDINE-4, 3'-INDOLE] 2, 2', 5' (1H) TRIONES FOR TREATMENT OF CONDITIONS ASSOCIATED WITH VANILLOID RECEPTOR 1 | ASTRAZENECA AB (SE) | 2007-08-16 | — | — | WO | disclosed |