Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 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 | |
|---|---|---|---|---|
| SCHEMBL4959934 | 0.91 | CYP1A2 (0.38) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4959933 | 0.85 | CYP1A2 (0.41) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4958548 | 0.79 | CES2 (0.35) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4962125 | 0.76 | CYP1A2 (0.41) | CYP1A2GAASMN1; SMN2NPSR1CYP2D6 | |
| SCHEMBL4960423 | 0.75 | CYP1A2 (0.38) | CYP1A2GAASMN1; SMN2NPSR1CYP2D6 | |
| SCHEMBL4959455 | 0.73 | CYP1A2 (0.42) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4960151 | 0.73 | PNMT (0.40) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4960360 | 0.72 | CYP1A2 (0.33) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4958173 | 0.71 | PNMT (0.38) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM | |
| SCHEMBL4960105 | 0.70 | SMN1; SMN2 (0.43) | CYP1A2SMN1; SMN2NPSR1CYP2D6PKM |
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 |