Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 2/20 | 0.42 |
| ▸ | MC5R | P33032 | 2/20 | 0.42 |
| ▸ | MC3R | P41968 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL5833046 | 0.97 | MC4R (0.45) | MC4RMC5RMC3RCXCR4CHRM2 | |
| SCHEMBL10483999 | 0.93 | MC4R (0.47) | MC4RMC5RMC3RCXCR4CHRM2 | |
| SCHEMBL10483864 | 0.81 | SIGMAR1 (0.47) | HDAC1CYP11B1CYP11B2NOS1 | |
| SCHEMBL7996321 | 0.80 | CHRM2 (0.43) | CXCR4CHRM2HDAC1CYP11B1CYP11B2 | |
| SCHEMBL5884099 | 0.80 | MC4R (0.42) | MC4RMC5RMC3RCXCR4CHRM2 | |
| SCHEMBL5884859 | 0.80 | KDM4E (0.50) | MC4RMC5RMC3RCHRM2HDAC1 | |
| SCHEMBL7981951 | 0.79 | CXCR4 (0.38) | CXCR4CHRM2HDAC1CYP11B1CYP11B2 | |
| SCHEMBL10863389 | 0.77 | MC4R (0.46) | MC4RMC5RMC3RCXCR4CHRM2 | |
| SCHEMBL23124232 | 0.77 | CYP2A6 (0.48) | CYP11B1CYP11B2MAOBCYP3A4 | |
| SCHEMBL7995384 | 0.77 | MC4R (0.41) | MC4RMC5RMC3RCXCR4CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE39140-E1 | Heterocyclic compounds | BAYER CROPSCIENCE K.K. (JP) | 2006-06-20 | — | — | US | disclosed |
| US-RE39129-E1 | Heterocyclic compounds | BAYER CROPSCIENCE K.K. (JP) | 2006-06-13 | — | — | US | disclosed |