Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 14/20 | 0.71 |
| ▸ | ACE | P12821 | 1/20 | 0.71 |
| ▸ | ECE1 | P42892 | 1/20 | 0.71 |
| ▸ | TNKS | O95271 | 1/20 | 0.52 |
| ▸ | XRCC6 | P12956 | 1/20 | 0.51 |
| ▸ | XRCC5 | P13010 | 1/20 | 0.51 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.46 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL31035740 | 0.84 | PRKDC (0.75) | PRKDCACEECE1XRCC6XRCC5 | |
| SCHEMBL30218216 | 0.83 | PRKDC (1.00) | PRKDCACEECE1XRCC6XRCC5 | |
| SCHEMBL3361567 | 0.83 | PRKDC (1.00) | PRKDCACEECE1XRCC6XRCC5 | |
| SCHEMBL25246006 | 0.82 | PRKDC (0.71) | PRKDCACEECE1XRCC6XRCC5 | |
| SCHEMBL5476610 | 0.82 | PRKDC (0.71) | PRKDCACEECE1XRCC6XRCC5 | |
| SCHEMBL3538463 | 0.79 | PRKDC (0.78) | PRKDCPIK3R1PIK3CAMTORTDP1 | |
| SCHEMBL7294524 | 0.75 | SIGMAR1 (0.76) | PRKDCACEECE1TNKSALDH1A1 | |
| SCHEMBL14081448 | 0.74 | TNKS (0.47) | PRKDCACEECE1TNKSMAOB | |
| SCHEMBL8788233 | 0.72 | ACE (0.58) | PRKDCACEECE1TNKSMAOB | |
| SCHEMBL7324233 | 0.72 | HTR6 (0.56) | PRKDCXRCC6XRCC5HRH4PIK3CA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5703075-A | Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones | PHARMACIA & UPJOHN COMPANY (US) | 1997-12-30 | — | — | US | disclosed |
| EP-0459983-A1 | ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES | PHARMACIA & UPJOHN COMPANY (US) | 1991-12-11 | — | — | EP | disclosed |
| WO-1990006921-A1 | ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES | THE UPJOHN COMPANY (US) | 1990-06-28 | — | — | WO | disclosed |