Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 3/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6874375 | 1.00 | SIGMAR1 (0.49) | SIGMAR1ACHEAURKBAURKASMN1; SMN2 | |
| SCHEMBL6876181 | 0.91 | SIGMAR1 (0.50) | SIGMAR1ACHEALDH1A1LMNAMEN1 | |
| SCHEMBL6876176 | 0.91 | SIGMAR1 (0.50) | SIGMAR1ACHEALDH1A1LMNAMEN1 | |
| SCHEMBL6875725 | 0.90 | AURKB (0.43) | SIGMAR1ACHEAURKBAURKASMN1; SMN2 | |
| SCHEMBL6875736 | 0.90 | AURKB (0.43) | SIGMAR1ACHEAURKBAURKASMN1; SMN2 | |
| SCHEMBL6869412 | 0.87 | EPHX2 (0.55) | SIGMAR1ACHEAURKBAURKASMN1; SMN2 | |
| SCHEMBL6869407 | 0.87 | EPHX2 (0.55) | SIGMAR1ACHEAURKBAURKASMN1; SMN2 | |
| SCHEMBL6876573 | 0.86 | AURKB (0.54) | SIGMAR1AURKBAURKASMN1; SMN2CNR1 | |
| SCHEMBL6876586 | 0.86 | AURKB (0.54) | SIGMAR1AURKBAURKASMN1; SMN2CNR1 | |
| SCHEMBL6869319 | 0.86 | MCHR1 (0.55) | SIGMAR1AURKBAURKASMN1; SMN2ALDH1A1 |
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 |