Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 19/20 | 0.64 |
| ▸ | ITGAV | P06756 | 19/20 | 0.64 |
| ▸ | ITGA2B | P08514 | 18/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448110 | 0.91 | ITGB3 (0.64) | ITGB3ITGAVITGA2B | |
| SCHEMBL3366048 | 0.91 | ITGB3 (0.64) | ITGB3ITGAVITGA2B | |
| SCHEMBL7138885 | 0.90 | ITGB3 (0.76) | ITGB3ITGAVITGA2B | |
| SCHEMBL3368836 | 0.90 | ITGB3 (0.76) | ITGB3ITGAVITGA2B | |
| Hydrochloric Acid SCHEMBL3366046 | 0.90 | ITGB3 (0.64) | ITGB3ITGAVITGA2B | |
| Acetic Acid SCHEMBL3369129 | 0.89 | ITGB3 (0.64) | ITGB3ITGAVITGA2B | |
| SCHEMBL14253147 | 0.80 | ITGB3 (0.52) | ITGB3ITGAVITGA2B | |
| SCHEMBL6016329 | 0.79 | ITGB3 (0.85) | ITGB3ITGAVITGA2B | |
| SCHEMBL6016326 | 0.79 | ITGB3 (0.85) | ITGB3ITGAVITGA2B | |
| SCHEMBL7216246 | 0.79 | ITGB3 (0.64) | ITGB3ITGAVITGA2BMEN1KMT2A |
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-1326847-B1 | (2S)-2-(ADAMANTAN-1-YLMETHOXYCARBONYLAMINO)-3-(4-(2-(1,4,5,6-TETRAHYDROPYRIMIDIN-2-YLCARBAMOYL)ETHYL)BENZOYLAMINO)PROPIONIC ACID ISOPROPYL ESTER, ITS PREPARATION AND ITS USE | AVENTIS PHARMA GMBH (DE) | 2010-05-05 | — | — | EP | disclosed |
| EP-1326847-A1 | (2S)-2-(ADAMANTAN-1-YLMETHOXYCARBONYLAMINO)-3-(4-(2-(1,4,5,6-TETRAHYDROPYRIMIDIN-2-YLCARBAMOYL)ETHYL)BENZOYLAMINO)PROPIONIC ACID ISOPROPYL ESTER, ITS PREPARATION AND ITS USE | Aventis Pharma Deutschland GmbH (DE) | 2003-07-16 | — | — | EP | disclosed |