Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.40 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.37 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.37 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL686842 | 0.90 | PTGER3 (0.45) | ALDH1A1RXFP1CNR2ITGB1ITGA4 | |
| SCHEMBL688317 | 0.90 | CNR2 (0.43) | SMN1; SMN2ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL688053 | 0.89 | PTGER3 (0.43) | SMN1; SMN2ALDH1A1MAPK1RXFP1CNR2 | |
| SCHEMBL687998 | 0.88 | CNR2 (0.43) | SMN1; SMN2ALDH1A1MAPK1RXFP1CNR2 | |
| SCHEMBL686896 | 0.88 | PTGER3 (0.44) | CNR2PTGER3SLC22A12 | |
| SCHEMBL29371834 | 0.88 | PTGER3 (0.44) | CNR2PTGER3SLC22A12 | |
| SCHEMBL688284 | 0.88 | PTGER3 (0.43) | SMN1; SMN2ALDH1A1MAPK1CNR2ITGB1 | |
| SCHEMBL687791 | 0.88 | PTGER3 (0.43) | SMN1; SMN2ALDH1A1KMT2AMEN1RXFP1 | |
| SCHEMBL687923 | 0.87 | PTGER3 (0.41) | CNR2ITGB1ITGA4PTGER3SLC22A12 | |
| SCHEMBL687533 | 0.87 | MAPT (0.46) | CNR2ITGB1ITGA4MAPTPTGER3 |
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 |