Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4958548 | 0.74 | CES2 (0.35) | SMN1; SMN2CYP1A2PKMCYP2D6NPSR1 | |
| SCHEMBL4959933 | 0.74 | CYP1A2 (0.41) | SMN1; SMN2CYP1A2LMNAKDM4EPKM | |
| SCHEMBL4962125 | 0.74 | CYP1A2 (0.41) | SMN1; SMN2CYP1A2LMNAKDM4EPKM | |
| SCHEMBL4959934 | 0.72 | CYP1A2 (0.38) | SMN1; SMN2CYP1A2PKMCYP2D6NPSR1 | |
| SCHEMBL4958729 | 0.71 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP1A2PKMCYP2D6NPSR1 | |
| SCHEMBL4960360 | 0.70 | CYP1A2 (0.33) | SMN1; SMN2CYP1A2PKMCYP2D6NPSR1 | |
| SCHEMBL4960105 | 0.68 | SMN1; SMN2 (0.43) | SMN1; SMN2CYP1A2PKMCYP2D6NPSR1 | |
| SCHEMBL4960423 | 0.68 | CYP1A2 (0.38) | SMN1; SMN2CYP1A2KDM4EPKMCYP2D6 | |
| SCHEMBL4962975 | 0.65 | ALOX5 (0.46) | LMNAHTT | |
| SCHEMBL16793190 | 0.64 | AOC3 (0.49) | SMN1; SMN2AOC3CYP1A2LMNAKDM4E |
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 |