Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6879679 | 1.00 | TSHR (0.47) | TSHRMCHR1MAPTHTTHPGD | |
| SCHEMBL6878921 | 0.88 | MCHR1 (0.42) | MCHR1ADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL6878928 | 0.88 | MCHR1 (0.42) | MCHR1ADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL6460241 | 0.87 | ALDH1A1 (0.46) | TSHRMCHR1HTTADORA3ADORA2A | |
| SCHEMBL6460258 | 0.87 | ALDH1A1 (0.46) | TSHRMCHR1HTTADORA3ADORA2A | |
| SCHEMBL6457914 | 0.83 | CCR1 (0.43) | MCHR1MAPK8CYP2C9CCNE1CDK2 | |
| SCHEMBL6457922 | 0.83 | CCR1 (0.43) | MCHR1MAPK8CYP2C9CCNE1CDK2 | |
| SCHEMBL6867727 | 0.82 | TSHR (0.43) | TSHRMCHR1HPGDCNR1KCNH2 | |
| SCHEMBL6455514 | 0.82 | LMNA (0.50) | MCHR1HTTHPGDSMN1; SMN2MAPK1 | |
| SCHEMBL6455521 | 0.82 | LMNA (0.50) | MCHR1HTTHPGDSMN1; SMN2MAPK1 |
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 |