Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.54 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.54 |
| ▸ | PLAU | P00749 | 7/20 | 0.48 |
| ▸ | HPN | P05981 | 7/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 3/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | ADAM10 | O14672 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | ADAM8 | P78325 | 1/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11323333 | 0.92 | ITGB3 (0.51) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| Methyl P-Toluenesulfonyl-L-Argininate SCHEMBL324561 | 0.89 | ITGB3 (0.57) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| Methyl P-Toluenesulfonyl-L-Argininate SCHEMBL2853451 | 0.89 | ITGB3 (0.57) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| Methyl P-Toluenesulfonyl-L-Argininate SCHEMBL1034821 | 0.88 | ITGB3 (0.56) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| Methyl P-Toluenesulfonyl-L-Argininate SCHEMBL11880215 | 0.88 | ITGB3 (0.56) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| SCHEMBL1839480 | 0.88 | ITGB3 (0.56) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| SCHEMBL1839478 | 0.88 | ITGB3 (0.56) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| SCHEMBL1244355 | 0.86 | ITGB3 (0.60) | ITGB3ITGA2BPLAUHPNALDH1A1 | |
| SCHEMBL1509767 | 0.85 | ITGB3 (0.71) | ITGB3ITGA2BPLAUHPNMMP2 | |
| Hydrochloric Acid SCHEMBL7319933 | 0.85 | ITGB3 (0.59) | ITGB3ITGA2BPLAUHPNALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015187929-A1 | TREATMENT OF FRAGILE X SYNDROME BY INHIBITION OF CDH1-APC | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2015-12-10 | — | — | WO | disclosed |