Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.55 |
| ▸ | GRM4 | Q14833 | 13/20 | 0.48 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.38 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | FADS1 | O60427 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL2235375 | 0.83 | GRM4 (0.58) | EPHX2GRM4SGMS1SGMS2NPC1 | |
| Hydrochloric Acid SCHEMBL2234357 | 0.82 | GRM4 (0.56) | EPHX2GRM4SGMS1SGMS2NPC1 | |
| SCHEMBL2234997 | 0.80 | EPHX2 (0.60) | EPHX2GRM4CYP1A2 | |
| SCHEMBL2236658 | 0.79 | EPHX2 (0.60) | EPHX2GRM4 | |
| SCHEMBL6923443 | 0.78 | EPHX2 (0.69) | EPHX2GRM4SGMS1SGMS2HPGD | |
| SCHEMBL6923970 | 0.77 | GRM4 (0.60) | EPHX2GRM4NPC1RAB9ACYP1A2 | |
| SCHEMBL6922842 | 0.77 | EPHX2 (0.64) | EPHX2GRM4CYP1A2 | |
| SCHEMBL14804992 | 0.76 | GRM4 (0.59) | EPHX2GRM4NPC1HTTRAB9A | |
| SCHEMBL6922687 | 0.76 | EPHX2 (0.56) | EPHX2GRM4CYP1A2 | |
| SCHEMBL14804987 | 0.74 | GRM4 (0.56) | EPHX2GRM4SGMS2HTTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011100614-A1 | BENZISOXAZOLES AND AZABENZISOXAZOLES AS mgluR4 ALLOSTERIC POTENTIATORS, COMPOSITIONS, AND METHODS OF TREATING NEUROLOGICAL DYSFUNCTION | VANDERBILT UNIVERSITY (US) | 2011-08-18 | — | — | WO | disclosed |