Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PPIA | P62937 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL27566023 | 0.85 | POLB (0.40) | TBXA2RLMNAPOLBALDH1A1THRB | |
| SCHEMBL27499149 | 0.85 | LMNA (0.38) | TBXA2RLMNAPOLBALDH1A1THRB | |
| SCHEMBL27539107 | 0.83 | LMNA (0.41) | MEN1KMT2ATBXA2RLMNAPOLB | |
| SCHEMBL28742591 | 0.82 | HCAR3 (0.38) | MEN1KMT2ATBXA2RL3MBTL1LMNA | |
| SCHEMBL27641481 | 0.82 | AR (0.41) | TBXA2RLMNASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL27500364 | 0.81 | ALDH1A1 (0.37) | NPC1RAB9ATBXA2RL3MBTL1LMNA | |
| SCHEMBL27539464 | 0.81 | ALDH1A1 (0.41) | MEN1KMT2ATBXA2RL3MBTL1LMNA | |
| SCHEMBL27485408 | 0.80 | MAPT (0.42) | MEN1KMT2ATBXA2RLMNAPOLB | |
| SCHEMBL27472206 | 0.80 | LMNA (0.49) | NPC1RAB9AMEN1KMT2ATBXA2R | |
| SCHEMBL27539111 | 0.79 | AR (0.41) | TBXA2RLMNASMN1; SMN2ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1856312-A | Combination of mGluR2 antagonist and AChE inhibitor for treatment of acute and/or chronic neurological disorders | HOFFMANN LA ROCHE (CH) | 2006-11-01 | — | — | CN | disclosed |
| CN-1264825-C | Dihydro-benzo [ b ] [1,4] diazepin * -2-one derivatives as mGluR2 antagonists II | HOFFMANN LA ROCHE (CH) | 2006-07-19 | — | — | CN | disclosed |
| CN-1535266-A | Dihydro-benzo [b][1,4] diazepin-2-one derivatives as mglur 2 antagonists II | - | 2004-10-06 | — | — | CN | disclosed |