Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL6866555 | 1.00 | TSHR (0.57) | TSHRMAPK1ALDH1A1GAAHPGD | |
| SCHEMBL6867727 | 0.90 | TSHR (0.43) | TSHRALDH1A1GAAHPGDMAPK8 | |
| SCHEMBL6457914 | 0.86 | CCR1 (0.43) | MAPK8CYP2C9CCNE1CDK2MAPK9 | |
| SCHEMBL6457922 | 0.86 | CCR1 (0.43) | MAPK8CYP2C9CCNE1CDK2MAPK9 | |
| SCHEMBL6880601 | 0.82 | LMNA (0.41) | GAALMNAMAPK8CYP2C9CCNE1 | |
| SCHEMBL6880608 | 0.82 | LMNA (0.41) | GAALMNAMAPK8CYP2C9CCNE1 | |
| SCHEMBL6877430 | 0.81 | MAPK8 (0.41) | MAPK8CYP2C9CCNE1CDK2MAPK9 | |
| SCHEMBL6877427 | 0.81 | MAPK8 (0.41) | MAPK8CYP2C9CCNE1CDK2MAPK9 | |
| SCHEMBL6879679 | 0.80 | TSHR (0.47) | TSHRMAPK1HPGDMAPK8CYP2C9 | |
| SCHEMBL6879696 | 0.80 | TSHR (0.47) | TSHRMAPK1HPGDMAPK8CYP2C9 |
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 |