Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2483233 | 0.64 | ACE (0.35) | ACECYP2C19POLBBLMATM | |
| SCHEMBL10897088 | 0.63 | ACE (0.36) | ACEPOLB | |
| SCHEMBL14280310 | 0.63 | LMNA (0.36) | — | |
| SCHEMBL3771628 | 0.61 | — | — | |
| SCHEMBL11573449 | 0.61 | — | — | |
| SCHEMBL25000890 | 0.60 | ITGB3 (0.32) | — | |
| SCHEMBL766758 | 0.60 | PIK3CD (0.37) | ACECYP2C19 | |
| Acetic Acid SCHEMBL9900974 | 0.59 | ACE (0.46) | ACECYP2C19POLBBLMATM | |
| SCHEMBL22390695 | 0.58 | — | — | |
| SCHEMBL22551299 | 0.58 | CYP2C19 (0.60) | CYP2C19POLBBLMATM |
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-7314959-B2 | Amino thiol compounds and compositions for use in conjunction with cancer therapy | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2008-01-01 | — | — | US | disclosed |
| US-7314959-B2 | Amino thiol compounds and compositions for use in conjunction with cancer therapy | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2008-01-01 | — | — | US | disclosed |