Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2660604 | 0.94 | EPHX2 (0.42) | CYP1A2EPHX1SIGMAR1EPHX2 | |
| SCHEMBL31035976 | 0.87 | CYP1A2 (0.41) | CYP1A2EPHX1SIGMAR1EPHX2CYP2D6 | |
| SCHEMBL16135444 | 0.87 | CYP1A2 (0.41) | CYP1A2EPHX1SIGMAR1EPHX2CYP2D6 | |
| Hydrochloric Acid SCHEMBL4745599 | 0.85 | CYP1A2 (0.40) | CYP1A2EPHX1SIGMAR1EPHX2CYP2D6 | |
| Methylamine SCHEMBL11372942 | 0.82 | CYP1A2 (0.38) | CYP1A2EPHX1SIGMAR1CYP2D6CYP2C19 | |
| SCHEMBL21680747 | 0.80 | — | — | |
| SCHEMBL30627247 | 0.80 | SIGMAR1 (0.44) | CYP1A2EPHX1SIGMAR1EPHX2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11372946 | 0.79 | SIGMAR1 (0.43) | CYP1A2EPHX1SIGMAR1EPHX2CYP2D6 | |
| SCHEMBL16622618 | 0.78 | MAOB (0.38) | SIGMAR1 | |
| SCHEMBL6062101 | 0.78 | ALDH1A1 (0.39) | EPHX1MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1904466-A1 | DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS | Novo Nordisk A/S (DK) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007006760-A1 | DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS | NOVO NORDISK A/S (DK) | 2007-01-18 | — | — | WO | disclosed |
| CN-1290926-C | Lactic acid polymer composition and molded object thereof | NEW JAPAN CHEM CO LTD (JP) | 2006-12-20 | — | — | CN | disclosed |
| CN-1585802-A | Lactic acid polymer composition and molded object thereof | NEW JAPAN CHEM CO LTD (JP) | 2005-02-23 | — | — | CN | disclosed |
| US-3944590-A | ALKYL PHENYL CARBONATES | CIBA-GEIGY CORPORATION (US) | 1976-03-16 | — | — | US | disclosed |