Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | MMP14 | P50281 | 1/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.49 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.49 |
| ▸ | TACR1 | P25103 | 1/20 | 0.48 |
| ▸ | MME | P08473 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.48 |
| ▸ | CPA1 | P15085 | 1/20 | 0.48 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL15314103 | 1.00 | TDP1 (0.52) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL27480508 | 0.86 | CTNNB1 (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL9848708 | 0.86 | CTNNB1 (0.60) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL27457905 | 0.85 | CTNNB1 (0.49) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL27647716 | 0.84 | CTSS (0.52) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL6018283 | 0.83 | ATM (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL7896757 | 0.83 | ATM (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL15446213 | 0.83 | ATM (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL6018293 | 0.83 | ATM (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM | |
| SCHEMBL1902233 | 0.83 | ATM (0.50) | TDP1KDM4EALDH1A1CTNNB1ATM |
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 |
|---|---|---|---|---|---|---|---|
| US-5610177-A | Acylated amino acids as endothelin antagonists | WARNER-LAMBERT COMPANY (US) | 1997-03-11 | — | — | US | disclosed |