Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 5/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL4169552 | 0.81 | AKR1B1 (0.45) | AKR1B1PTGDR2AKR1A1 | |
| SCHEMBL3957233 | 0.78 | CYP1A2 (0.39) | CYP1A2MAPTCYP2C19KMT2ABCHE | |
| SCHEMBL4976847 | 0.76 | TRAP1 (0.39) | ALDH1A1CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL4979296 | 0.75 | AKR1B1 (0.41) | ALDH1A1CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL3950566 | 0.75 | AKR1B1 (0.42) | CYP1A2MAPTCYP2C19KMT2ABCHE | |
| SCHEMBL2483991 | 0.75 | CNR1 (0.51) | ALDH1A1MAPTCYP2C19KMT2ACNR1 | |
| SCHEMBL3954635 | 0.75 | PTGDR2 (0.39) | KMT2ACNR1AKR1B1PTGDR2 | |
| SCHEMBL2486352 | 0.74 | PTGDR2 (0.62) | AKR1B1PTGDR2CYP2C9 | |
| SCHEMBL3952571 | 0.72 | OPRL1 (0.43) | ALDH1A1CYP1A2MAPTCYP2C19KMT2A | |
| SCHEMBL2484248 | 0.71 | PTGDR2 (0.64) | ALDH1A1MAPTKMT2APTGDR2HTR7 |
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-2013216-A2 | NOVEL SPIRO [IMIDAZOLIDINE-4, 3' -INDOLE] 2, 2', 5' (1H) TRIONES FOR TREATMENT OF CONDITIONS ASSOCIATED WITH VANILLOID RECEPTOR 1 | AstraZeneca AB (SE) | 2009-01-14 | — | — | EP | claimed |
| WO-2007091948-A2 | NOVEL 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 | claimed |