Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.62 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | HTR6 | P50406 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HTR5A | P47898 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10261961 | 0.96 | GPR84 (0.67) | GPR84HTR2AHTR2CHTR2BHTR6 | |
| SCHEMBL1253972 | 0.83 | GPR84 (0.62) | GPR84HTR2ALMNAHTTHPGD | |
| SCHEMBL12850609 | 0.79 | HTR2A (0.65) | GPR84HTR2AHTR2CHTR2BHTR6 | |
| SCHEMBL27559084 | 0.79 | ALDH1A1 (0.58) | GPR84HTR2AHTR2CHTR2BHTR6 | |
| SCHEMBL14159329 | 0.78 | GPR84 (0.71) | GPR84HTR2ALMNAALDH1A1CA2 | |
| SCHEMBL20548794 | 0.78 | GPR84 (0.71) | GPR84HTR2ALMNAHPGDALDH1A1 | |
| SCHEMBL5881100 | 0.77 | GPR84 (1.00) | GPR84HTR2ALMNAALDH1A1CA2 | |
| SCHEMBL30807873 | 0.77 | HTR6 (0.54) | GPR84HTR2AHTR2CHTR2BHTR6 | |
| SCHEMBL30056181 | 0.76 | GPR84 (0.54) | GPR84HTR2ALMNAHTTHPGD | |
| SCHEMBL1719807 | 0.76 | BRD4 (0.59) | HTR2AHTR2CHTR2BHTR6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1440976-B1 | Modified aminoacids, pharmaceuticals containing these compounds and method for their production | BOEHRINGER INGELHEIM PHARMA (DE) | 2008-07-23 | — | — | EP | disclosed |
| EP-1440976-A1 | Modified aminoacids, pharmaceuticals containing these compounds and method for their production | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 2004-07-28 | — | — | EP | disclosed |
| EP-0927192-B1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-05-12 | — | — | EP | disclosed |