Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dimethyl Sulfoxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.58 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | ADK | P55263 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL771236 | 0.89 | NISCH (0.64) | NISCHMTORADKALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL28346045 | 0.87 | NISCH (0.62) | NISCHMTORADKALDH1A1KDM4E | |
| Bromide SCHEMBL28348957 | 0.87 | NISCH (0.62) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL29160561 | 0.82 | NISCH (0.56) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL29160555 | 0.82 | NISCH (0.56) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL8615820 | 0.81 | NISCH (0.59) | NISCHMTORADKALDH1A1KDM4E | |
| Ethylene Glycol SCHEMBL27721441 | 0.81 | NISCH (0.55) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL1386454 | 0.79 | CYP1A2 (0.55) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL722191 | 0.79 | NISCH (0.78) | NISCHMTORADKALDH1A1KDM4E | |
| SCHEMBL27729782 | 0.77 | NISCH (0.54) | NISCHMTORADKALDH1A1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102762568-A | Pteridinones as inhibitors of polo - like kinase | ELAN PHARM INC | 2012-10-31 | — | — | CN | disclosed |