Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Modafinil. 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 | |
|---|---|---|---|---|
| ▸ | SLC6A3 known ✓ | Q01959 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | EDNRB | P24530 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | MC3R | P41968 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | DCAF1 | Q9Y4B6 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9216087 | 0.95 | CNR2 (0.42) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Modafinil SCHEMBL1560974 | 0.92 | CYP2D6 (0.44) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Armodafinil SCHEMBL34489 | 0.92 | CYP2D6 (0.44) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Modafinil SCHEMBL34488 | 0.92 | CYP2D6 (0.44) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Modafinil SCHEMBL3238686 | 0.92 | CYP2D6 (0.44) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| (S)-Modafinil SCHEMBL1403524 | 0.92 | CYP2D6 (0.44) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL8611984 | 0.91 | MEN1 (0.44) | NPSR1LMNAMAPK1DCAF1 | |
| Modafinil SCHEMBL193837 | 0.90 | CYP2D6 (0.41) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Modafinil SCHEMBL3908867 | 0.89 | EPHX1 (0.42) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Modafinil SCHEMBL19025521 | 0.87 | PKM (0.41) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1718607-A4 | MODAFINIL COMPOSITIONS | CEPHALON INC (US) | 2008-05-28 | — | — | EP | disclosed |
| EP-1718607-A1 | MODAFINIL COMPOSITIONS | CEPHALON, INC. (US) | 2006-11-08 | — | — | EP | disclosed |
| WO-2005077894-A1 | MODAFINIL COMPOSITIONS | CEPHALON, INC. (US) | 2005-08-25 | — | — | WO | disclosed |