Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL7788304 | 0.83 | ITGB3 (0.42) | SMN1; SMN2POLBITGB3ITGA2B | |
| SCHEMBL7194899 | 0.82 | ITGB3 (0.44) | KMT2AMEN1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL7790182 | 0.82 | SMN1; SMN2 (0.42) | LMNASMN1; SMN2POLBITGB3ITGA2B | |
| SCHEMBL7788171 | 0.81 | SMN1; SMN2 (0.43) | LMNASMN1; SMN2MAPTITGB3ITGA2B | |
| SCHEMBL7788768 | 0.79 | ATM (0.40) | LMNASMN1; SMN2POLBALDH1A1MAPT | |
| SCHEMBL7785595 | 0.79 | MMP12 (0.42) | KMT2AMEN1SMN1; SMN2ALDH1A1ALOX12 | |
| SCHEMBL7781206 | 0.79 | ITGB3 (0.42) | KMT2AMEN1ALOX12MAPTCA9 | |
| SCHEMBL7191718 | 0.79 | ALDH1A1 (0.36) | KMT2AMEN1SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL7789969 | 0.78 | CYP26A1 (0.42) | LMNASMN1; SMN2ALDH1A1MAPTITGB3 | |
| SCHEMBL7790178 | 0.78 | CTSA (0.41) | KMT2AMEN1MAPTITGB3ITGA2B |
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-1147079-A2 | BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | Bayer Aktiengesellschaft (DE) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000041469-A2 | β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-07-20 | — | — | WO | disclosed |