Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 2/20 | 0.42 |
| ▸ | MC5R | P33032 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MC3R | P41968 | 1/20 | 0.41 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5833866 | 0.97 | MC4R (0.45) | MC4RMC5RGAAMC3RSCN8A | |
| SCHEMBL10483919 | 0.93 | MC4R (0.47) | MC4RMC5RGAAMC3RSCN8A | |
| SCHEMBL14747536 | 0.81 | GAA (0.44) | GAASCN8ACHRM2NAMPTPDCD1 | |
| SCHEMBL5884684 | 0.80 | MC4R (0.42) | MC4RMC5RMC3RSCN8ACHRM2 | |
| SCHEMBL28103835 | 0.80 | HRH4 (0.59) | SCN8ACHRM2KDM4ECYP1A2CYP2C19 | |
| SCHEMBL5884859 | 0.80 | KDM4E (0.50) | MC4RMC5RGAAMC3RCHRM2 | |
| SCHEMBL7999060 | 0.80 | CHRM2 (0.43) | GAASCN8ACHRM2KDM4ENAMPT | |
| SCHEMBL7981959 | 0.79 | GAA (0.43) | GAASCN8ACHRM2KDM4ENAMPT | |
| SCHEMBL20037934 | 0.79 | GAA (0.43) | GAASCN8ACHRM2KDM4ENAMPT | |
| SCHEMBL20999188 | 0.79 | CD274 (0.55) | GAASCN8ACHRM2NAMPTPDCD1 |
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 |