Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 6/20 | 0.41 |
| ▸ | ATAD2 | Q6PL18 | 6/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.40 |
| ▸ | BPTF | Q12830 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4965097 | 0.82 | BRD4 (0.41) | BRD4ATAD2HTR4HRH3CYP1A2 | |
| SCHEMBL8243402 | 0.78 | HTR4 (0.51) | HTR4ALDH1A1 | |
| SCHEMBL8241534 | 0.76 | MAPT (0.48) | BRD4ATAD2CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL8242460 | 0.75 | MAPK1 (0.40) | BRD4ATAD2HRH3CYP1A2CYP2C9 | |
| SCHEMBL22725031 | 0.75 | IKBKB (0.42) | BRD4ATAD2HRH3CYP3A4ALDH1A1 | |
| SCHEMBL18263372 | 0.72 | P2RX7 (0.46) | BRD4ATAD2AXLTYRO3MERTK | |
| SCHEMBL12277378 | 0.72 | BRD4 (0.48) | BRD4ATAD2HRH3CYP1A2CYP3A4 | |
| SCHEMBL26350278 | 0.71 | BRD4 (0.41) | BRD4ATAD2HTR4HRH3CYP1A2 | |
| SCHEMBL602519 | 0.70 | ALOX15 (0.35) | CD44BRD4ATAD2HTR4HRH3 | |
| SCHEMBL602518 | 0.70 | ALOX15 (0.35) | CD44BRD4ATAD2HTR4HRH3 |
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-2007036718-A2 | COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE | GLAXO GROUP LIMITED (GB) | 2007-04-05 | — | — | WO | disclosed |