Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.57 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 2/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7302505 | 0.84 | ITGB3 (0.69) | ITGB3ITGA2BNPC1HTTKDM4E | |
| SCHEMBL9223672 | 0.80 | ITGB3 (0.56) | ITGB3ITGA2B | |
| SCHEMBL9223657 | 0.80 | ITGB3 (0.57) | ITGB3ITGA2BALDH1A1GFERNPC1 | |
| SCHEMBL30913839 | 0.74 | MEN1 (0.54) | ALDH1A1GFERHTTKDM4ETSHR | |
| SCHEMBL7353169 | 0.74 | ITGB3 (0.53) | ITGB3ITGA2BALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7298280 | 0.73 | SIGMAR1 (0.63) | ITGB3ITGA2BSIGMAR1HTTLMNA | |
| SCHEMBL7307903 | 0.73 | ITGB3 (0.57) | ITGB3ITGA2BALDH1A1GFERTPSAB1 | |
| SCHEMBL8384991 | 0.72 | ITGB3 (0.70) | ITGB3ITGA2BSMN1; SMN2 | |
| SCHEMBL7307205 | 0.72 | CHRM2 (0.43) | ALDH1A1SIGMAR1GAAMAPT | |
| SCHEMBL7297075 | 0.71 | ITGB3 (1.00) | ITGB3ITGA2B |
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-0445796-B1 | Derivatives of acetic acid containing peptide bonds | HOFFMANN LA ROCHE (CH) | 1998-06-17 | — | — | EP | disclosed |
| EP-0445796-A2 | Derivatives of acetic acid | F. HOFFMANN-LA ROCHE AG (CH) | 1991-09-11 | — | — | EP | disclosed |