Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.39 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ATIC | P31939 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | BMPR2 | Q13873 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL18542679 | 1.00 | MAP2K1 (0.39) | MAP2K1FKBP5CRBNGDAGAA | |
| SCHEMBL8310807 | 0.98 | FKBP5 (0.38) | MAP2K1FKBP5CRBNGDAGAA | |
| SCHEMBL8309980 | 0.93 | MAP2K1 (0.37) | MAP2K1GDAGAARAF1MAPK1 | |
| SCHEMBL8343167 | 0.85 | MAP2K1 (0.43) | MAP2K1CRBNGDARAF1MAPK1 | |
| SCHEMBL9076339 | 0.76 | TSHR (0.34) | GDAGAAATICTSHRPOLB | |
| SCHEMBL5752172 | 0.74 | — | — | |
| SCHEMBL2873901 | 0.72 | TSHR (0.36) | GDAMAPK1ATICTSHRPOLB | |
| SCHEMBL13577565 | 0.68 | ALDH1A1 (0.36) | GAATSHRPOLBALDH1A1CHEK1 | |
| SCHEMBL13911357 | 0.67 | GAA (0.50) | GAATSHRPOLBALDH1A1CHEK1 | |
| SCHEMBL12349970 | 0.67 | GAA (0.50) | GAATSHRPOLBALDH1A1CHEK1 |
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-8470854-B2 | Lactam-containing compounds and derivatives thereof as factor XA inhibitors | BRISTOL-MEYERS SQUIBB COMPANY (US) | 2013-06-25 | — | — | US | disclosed |