Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 4/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7142468 | 0.90 | ALOX5AP (0.37) | MAOBMYCHDAC2LMNAKDM4E | |
| SCHEMBL5868769 | 0.86 | CYP17A1 (0.45) | MAOBMYCWNT3AHDAC2HDAC1 | |
| SCHEMBL7464541 | 0.81 | BCHE (0.36) | MYCGSK3BPARP14ALDH1A1MEN1 | |
| SCHEMBL7527939 | 0.80 | RAB9A (0.38) | PARP14ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL7455415 | 0.80 | RAF1 (0.36) | GSK3BALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5868993 | 0.77 | CYP17A1 (0.40) | — | |
| SCHEMBL6609589 | 0.77 | MAPT (0.38) | HDAC1GSK3BALDH1A1MEN1MAPT | |
| SCHEMBL6612157 | 0.75 | ALDH1A1 (0.37) | MYCPARP14LMNAKDM4EALDH1A1 | |
| SCHEMBL6610697 | 0.75 | POLB (0.39) | HDAC4HDAC6PARP14ALDH1A1MEN1 | |
| SCHEMBL5868818 | 0.74 | CYP17A1 (0.41) | PARP14MAPT |
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-1224175-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001029012-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |