Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 12/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR1F | P30939 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4543865 | 0.81 | MTNR1B (0.47) | MTNR1BHTR6PSEN1PSEN2APH1B | |
| SCHEMBL28200484 | 0.81 | MTNR1B (0.44) | MTNR1BHTR6PSEN1PSEN2APH1B | |
| SCHEMBL3417907 | 0.81 | PTGDR2 (0.41) | MTNR1BHTR6SRCCYP1A2CYP3A4 | |
| SCHEMBL30644289 | 0.78 | HTR6 (0.46) | HTR6PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL597369 | 0.78 | HTR6 (0.46) | HTR6PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10004275 | 0.74 | NOD2 (0.60) | MTNR1BHTR6PSEN1PSEN2APH1B | |
| SCHEMBL25176785 | 0.74 | RAPGEF4 (0.50) | MTNR1BHTR6PSEN1PSEN2APH1B | |
| SCHEMBL31304851 | 0.74 | HTR6 (0.44) | HTR6SRCAGTR1 | |
| SCHEMBL4859176 | 0.74 | HTR6 (0.41) | MTNR1BHTR6SRCHTR1ADRD2 | |
| SCHEMBL4852200 | 0.73 | HTR6 (0.49) | MTNR1BHTR6PSEN1PSEN2APH1B |
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-2009112475-A1 | PYRROLO [2, 3-B] PYRIDIN DERIVATIVES AS IKK2 INHIBITORS | GLAXO GROUP LIMITED (GB) | 2009-09-17 | — | — | WO | disclosed |