Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL7453036 | 0.86 | ROCK2 (0.54) | TDP1PLA2G1BATG4BMAPTROCK2 | |
| SCHEMBL6996884 | 0.84 | MAPT (0.42) | CHRM1TDP1PLA2G1BATG4BMAPT | |
| SCHEMBL7001539 | 0.83 | MAPT (0.51) | CHRM1TDP1PLA2G1BATG4BMAPT | |
| SCHEMBL6993558 | 0.83 | MAPT (0.41) | CHRM1TDP1PLA2G1BATG4BMAPT | |
| SCHEMBL7225951 | 0.80 | MAPT (0.52) | TDP1PLA2G1BATG4BMAPTXBP1 | |
| SCHEMBL7226695 | 0.79 | GRIA2 (0.47) | TDP1PLA2G1BATG4BMAPTXBP1 | |
| SCHEMBL4970947 | 0.76 | HTR7 (0.44) | CHRM1TDP1PLA2G1BATG4BMAPT | |
| SCHEMBL7234076 | 0.76 | CYP1A2 (0.49) | TDP1PLA2G1BATG4BMAPTXBP1 | |
| SCHEMBL6716592 | 0.71 | MAPT (0.46) | CHRM1MAPTHTR7LMNAMEN1 | |
| SCHEMBL7445311 | 0.71 | HTR7 (0.41) | MAPTHTR7IDO1LMNAMEN1 |
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-1001956-A1 | NEW 2,3-BENZODIAZEPINE DERIVATIVES | GYOGYSZERKUTATO INTEZET KFT. (HU) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999006408-A1 | NEW 2,3-BENZODIAZEPINE DERIVATIVES | Gyógyszerkutató Intézet Kft. (HU) | 1999-02-11 | — | — | WO | disclosed |