Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 1/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.53 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.48 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.48 |
| ▸ | CTSS | P25774 | 6/20 | 0.47 |
| ▸ | CTSK | P43235 | 5/20 | 0.47 |
| ▸ | CTSL | P07711 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 5/20 | 0.46 |
| ▸ | PPARG | P37231 | 4/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.45 |
| ▸ | ITGAV | P06756 | 1/20 | 0.45 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.45 |
| ▸ | PPARD | Q03181 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7739238 | 0.88 | SMN1; SMN2 (0.47) | ACEITGB3ITGA2BCTSSCTSK | |
| SCHEMBL1430300 | 0.83 | ACE (0.59) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL2215278 | 0.83 | ACE (0.59) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL18262517 | 0.81 | ACE (0.59) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL18262522 | 0.81 | ACE (0.59) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL2219572 | 0.80 | ITGB3 (0.66) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL7086188 | 0.80 | ITGB3 (0.66) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL2219578 | 0.80 | ITGB3 (0.66) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL25284980 | 0.78 | ACE (0.64) | ACEITGB3ITGA2BITGA4ITGB7 | |
| SCHEMBL1458942 | 0.78 | PPARA (0.65) | ACEITGB3ITGA2BITGA4ITGB7 |
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 |
|---|---|---|---|---|---|---|---|
| US-6416861-B1 | COMBINATORIAL CHEMISTRY | NORTHWESTERN UNIVERSITY | 2002-07-09 | — | — | US | disclosed |
| WO-2000049022-A2 | ORGANOSILICON COMPOUNDS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2000-08-24 | — | — | WO | disclosed |