Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 7/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL6880494 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6879386 | 0.94 | MCHR1 (0.47) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6879382 | 0.94 | MCHR1 (0.47) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6873540 | 0.91 | NPY5R (0.49) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6873544 | 0.91 | NPY5R (0.49) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6867894 | 0.90 | MCHR1 (0.51) | ALDH1A1MCHR1ADRA2ANPY5RCTNNB1 | |
| SCHEMBL6867900 | 0.90 | MCHR1 (0.51) | ALDH1A1MCHR1ADRA2ANPY5RCTNNB1 | |
| SCHEMBL6876952 | 0.90 | NPC1 (0.44) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6876960 | 0.90 | NPC1 (0.44) | ALDH1A1MCHR1ADRA2AROCK2ROCK1 | |
| SCHEMBL6459241 | 0.88 | MCHR1 (0.53) | MCHR1ADRA2ANPY5RCTNNB1TCF7L2 |
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 |