Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GUCY1B2 | O75343 | 4/20 | 0.41 |
| ▸ | GUCY1A2 | P33402 | 4/20 | 0.41 |
| ▸ | GUCY1A1 | Q02108 | 4/20 | 0.41 |
| ▸ | GUCY1B1 | Q02153 | 4/20 | 0.41 |
| ▸ | CTSA | P10619 | 4/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL687715 | 0.89 | CTSA (0.39) | CTSAALDH1A1SMN1; SMN2MAPK1KDM4E | |
| SCHEMBL688286 | 0.88 | SMN1; SMN2 (0.39) | CTSAALDH1A1SMN1; SMN2MAPK1KDM4E | |
| SCHEMBL688273 | 0.88 | CTSA (0.38) | CTSAALDH1A1MAPK1KDM4EHPGD | |
| SCHEMBL687499 | 0.88 | CTSA (0.45) | CTSA | |
| SCHEMBL687851 | 0.87 | CTSA (0.38) | CTSAKEAP1NFE2L2ALDH1A1SMN1; SMN2 | |
| SCHEMBL688046 | 0.87 | CTSA (0.42) | CTSAKEAP1NFE2L2ALDH1A1SMN1; SMN2 | |
| SCHEMBL688146 | 0.85 | CTSA (0.41) | CTSAKEAP1NFE2L2ALDH1A1MAPK1 | |
| SCHEMBL686657 | 0.84 | CTSA (0.37) | CTSAALDH1A1SMN1; SMN2MAPK1FFAR1 | |
| SCHEMBL13120932 | 0.83 | MAPT (0.38) | ALDH1A1SMN1; SMN2MAPK1KDM4E | |
| SCHEMBL686721 | 0.82 | LMNA (0.42) | CTSAKEAP1NFE2L2ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1203766-B1 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC (US) | 2012-02-29 | — | — | EP | disclosed |
| EP-1203766-A2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | TEXAS BIOTECHNOLOGY CORPORATION (US) | 2002-05-08 | — | — | EP | disclosed |