Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | TDP2 | O95551 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.40 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8296653 | 0.86 | ALDH1A1 (0.41) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL8296655 | 0.84 | ALDH1A1 (0.44) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL5750459 | 0.81 | PARP1 (0.47) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL8312060 | 0.81 | ALDH1A1 (0.50) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL5749223 | 0.80 | PARP1 (0.46) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL14100436 | 0.79 | ALDH1A1 (0.48) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL8291883 | 0.79 | CYP1A2 (0.41) | ALDH1A1CYP3A4HPGDHSD17B10KDM4E | |
| SCHEMBL7047251 | 0.79 | HSD17B1 (0.47) | KMT2AMEN1PLAUCYP1A2 | |
| SCHEMBL8337839 | 0.79 | ALDH1A1 (0.41) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL14100438 | 0.77 | ALDH1A1 (0.44) | PARP1ALDH1A1CYP3A4HPGDHSD17B10 |
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-1427415-B1 | LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2009-08-12 | — | — | EP | disclosed |