Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 7/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4310465 | 0.81 | CYP1A2 (0.49) | CYP1A2CYP19A1ALDH1A1KMT2APPARG | |
| SCHEMBL4304641 | 0.80 | CYP1A2 (0.45) | CYP1A2LTA4HCYP19A1POLBPPARG | |
| SCHEMBL4311966 | 0.76 | CYP1A2 (0.46) | CYP1A2CYP19A1POLBMAPTKMT2A | |
| SCHEMBL4315990 | 0.75 | CYP1A2 (0.45) | CYP1A2CYP19A1PPARGPPARA | |
| SCHEMBL4309877 | 0.69 | ALDH1A1 (0.36) | CYP1A2CYP19A1ALDH1A1POLBKMT2A | |
| SCHEMBL4314433 | 0.68 | POLB (0.35) | CYP1A2ALDH1A1POLBKMT2A | |
| SCHEMBL4309847 | 0.66 | CYP1A2 (0.44) | CYP1A2MAPT | |
| SCHEMBL4304481 | 0.65 | POLB (0.35) | ALDH1A1POLBKMT2A | |
| SCHEMBL4312614 | 0.63 | KMT2A (0.43) | CYP1A2ALDH1A1POLBMAPTKMT2A | |
| SCHEMBL4311700 | 0.62 | POLB (0.43) | CYP1A2ALDH1A1POLBMAPTKMT2A |
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-1879873-A1 | NEUROTHERAPEUTIC AZOLE COMPOUNDS | SK Holdings Co., Ltd. (KR) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006112685-A1 | NEUROTHERAPEUTIC AZOLE COMPOUNDS | SK HOLDINGS CO., LTD. (KR) | 2006-10-26 | — | — | WO | disclosed |