Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.42 |
| ▸ | PRKACA | P17612 | 2/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6869316 | 1.00 | MCHR1 (0.55) | MCHR1SIGMAR1CYP3A4POLBAURKB | |
| SCHEMBL6876586 | 0.91 | AURKB (0.54) | MCHR1SIGMAR1CYP3A4AURKBCNR1 | |
| SCHEMBL6876573 | 0.91 | AURKB (0.54) | MCHR1SIGMAR1CYP3A4AURKBCNR1 | |
| SCHEMBL6868818 | 0.91 | CCR8 (0.51) | MCHR1SIGMAR1CYP3A4AURKBCNR1 | |
| SCHEMBL6868814 | 0.91 | CCR8 (0.51) | MCHR1SIGMAR1CYP3A4AURKBCNR1 | |
| SCHEMBL6455517 | 0.90 | CYP3A4 (0.47) | MCHR1SIGMAR1CYP3A4POLBAURKB | |
| SCHEMBL6455512 | 0.90 | CYP3A4 (0.47) | MCHR1SIGMAR1CYP3A4POLBAURKB | |
| SCHEMBL6460756 | 0.89 | SMN1; SMN2 (0.60) | MCHR1CYP3A4POLBAURKBCNR1 | |
| SCHEMBL6460771 | 0.89 | SMN1; SMN2 (0.60) | MCHR1CYP3A4POLBAURKBCNR1 | |
| SCHEMBL6869412 | 0.88 | EPHX2 (0.55) | MCHR1SIGMAR1CYP3A4POLBAURKB |
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 |