Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 2/20 | 0.57 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.53 |
| ▸ | ITGAV | P06756 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | CCKBR | P32239 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | F13A1 | P00488 | 1/20 | 0.46 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | TGM1 | P22735 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL13739250 | 0.93 | F2 (0.51) | F2ITGB3ITGA2BITGAVCCKBR | |
| SCHEMBL3947594 | 0.93 | BRD4 (0.52) | ITGB3ITGA2BITGAVBRD4CCKBR | |
| Hydrochloric Acid SCHEMBL3947595 | 0.91 | BRD4 (0.51) | ITGB3ITGA2BITGAVBRD4CCKBR | |
| SCHEMBL26246109 | 0.88 | ALDH1A1 (0.50) | ITGB3ITGA2BITGAVBRD4CCKBR | |
| SCHEMBL12723408 | 0.85 | CCKBR (0.50) | ITGB3ITGA2BITGAVCCKBRCHRM3 | |
| SCHEMBL3982387 | 0.85 | CCKBR (0.50) | ITGB3ITGA2BITGAVCCKBRCHRM3 | |
| Tert-Butyl Formate SCHEMBL27876082 | 0.84 | ITGB3 (0.51) | F2ITGB3ITGA2BITGAVBRD4 | |
| Pivalate SCHEMBL28284292 | 0.84 | ITGB3 (0.50) | F2ITGB3ITGA2BITGAVBRD4 | |
| Trifluoroacetic Acid SCHEMBL6379253 | 0.83 | ITGB3 (0.51) | F2ITGB3ITGA2BITGAVALDH1A1 | |
| SCHEMBL8393648 | 0.83 | LMNA (0.58) | ALDH1A1F13A1TGM2TGM1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0743320-A2 | Acyl guanidine and amidine prodrugs | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-11-20 | — | — | EP | disclosed |