Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6880046 | 1.00 | EPHX1 (0.49) | EPHX1ALDH1A1ADRA2AMCHR1MAPT | |
| SCHEMBL6876978 | 0.90 | MCHR1 (0.46) | ALDH1A1ADRA2AMCHR1MAPTHPGD | |
| SCHEMBL6876982 | 0.90 | MCHR1 (0.46) | ALDH1A1ADRA2AMCHR1MAPTHPGD | |
| SCHEMBL6872176 | 0.87 | LMNA (0.53) | ALDH1A1ADRA2AMCHR1MAPTSMN1; SMN2 | |
| SCHEMBL6872189 | 0.87 | LMNA (0.53) | ALDH1A1ADRA2AMCHR1MAPTSMN1; SMN2 | |
| SCHEMBL6457820 | 0.87 | ALDH1A1 (0.47) | ALDH1A1ADRA2AMCHR1MAPTHPGD | |
| SCHEMBL6457835 | 0.87 | ALDH1A1 (0.47) | ALDH1A1ADRA2AMCHR1MAPTHPGD | |
| SCHEMBL4029623 | 0.86 | MCHR1 (0.63) | EPHX1ALDH1A1ADRA2AMCHR1MAPT | |
| SCHEMBL4029620 | 0.86 | MCHR1 (0.63) | EPHX1ALDH1A1ADRA2AMCHR1MAPT | |
| SCHEMBL6458632 | 0.85 | MCHR1 (0.52) | ALDH1A1ADRA2AMCHR1MAPTSMN1; SMN2 |
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 |