Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.51 |
| ▸ | BACE1 | P56817 | 2/20 | 0.51 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.39 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6880731 | 1.00 | ACHE (0.51) | ACHEBACE1MCHR1CXCR4MAPK1 | |
| SCHEMBL7046703 | 0.91 | MCHR1 (0.51) | ACHEBACE1MCHR1MAPK8MAPK9 | |
| SCHEMBL7046707 | 0.91 | MCHR1 (0.51) | ACHEBACE1MCHR1MAPK8MAPK9 | |
| SCHEMBL6876983 | 0.89 | MCHR1 (0.45) | ACHEBACE1MCHR1CXCR4MAPK1 | |
| SCHEMBL6867690 | 0.88 | MCHR1 (0.44) | ACHEBACE1MCHR1MAPK8MAPK9 | |
| SCHEMBL6867696 | 0.88 | MCHR1 (0.44) | ACHEBACE1MCHR1MAPK8MAPK9 | |
| SCHEMBL6868802 | 0.88 | ACHE (0.46) | ACHEBACE1MCHR1CXCR4MAPK8 | |
| SCHEMBL6868799 | 0.88 | ACHE (0.46) | ACHEBACE1MCHR1CXCR4MAPK8 | |
| SCHEMBL6873515 | 0.84 | MCHR1 (0.44) | ACHEBACE1MCHR1MAPK1CDK2 | |
| SCHEMBL6873513 | 0.84 | MCHR1 (0.44) | ACHEBACE1MCHR1MAPK1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |