Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 5/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 2/20 | 0.33 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | CTSS | P25774 | 2/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL27644625 | 0.78 | KDM1A (0.40) | CCNA2CDK2NOS2HRH3CDK5 | |
| SCHEMBL4413610 | 0.77 | CTSL (0.41) | CCNA2CDK2NOS2KDM1AMAOB | |
| SCHEMBL10820261 | 0.77 | NPC1 (0.43) | KDM1AMAOBMAPK1HTR6BRD4 | |
| Hydrochloric Acid SCHEMBL71413 | 0.75 | ACKR3 (0.42) | KDM1AMAOBMAPK1HTR6ACKR3 | |
| SCHEMBL8244028 | 0.75 | HRH3 (0.36) | CCNA2CDK2NOS2HRH3CDK5 | |
| SCHEMBL4747092 | 0.75 | MAPT (0.41) | CCNA2CDK2MAPK1HTR6BRD4 | |
| SCHEMBL18403938 | 0.74 | HRH3 (0.41) | NOS2HRH3CDK5CDK5R1KDM1A | |
| SCHEMBL4965097 | 0.72 | BRD4 (0.41) | NOS2HRH3CDK5CDK5R1KDM1A | |
| SCHEMBL4697426 | 0.72 | NOS2 (0.50) | NOS2HRH3KDM1AMAOBMAPK1 | |
| SCHEMBL30847414 | 0.71 | ROCK2 (0.39) | KDM1AROCK2 |
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-2008119721-A1 | COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE | GLAXO GROUP LIMITED (GB) | 2008-10-09 | — | — | WO | disclosed |