Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.60 |
| ▸ | PKM | P14618 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7076669 | 0.91 | GAA (0.53) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7069977 | 0.90 | PKM (0.55) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7071584 | 0.89 | GAA (0.52) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7074862 | 0.87 | DGAT1 (0.53) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7075108 | 0.87 | GAA (0.48) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7074627 | 0.86 | TSHR (0.57) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7070017 | 0.86 | DGAT1 (0.50) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7075122 | 0.85 | LMNA (0.65) | ALDH1A1SMN1; SMN2NPSR1HDAC4TSHR | |
| SCHEMBL7075151 | 0.84 | HDAC4 (0.49) | GAAPKMALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL7076852 | 0.84 | MAPT (0.54) | GAAPKMALDH1A1SMN1; SMN2NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1025086-B1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GMBH (DE) | 2003-06-25 | — | — | EP | disclosed |
| US-6492368-B1 | Benzamidine derivatives as factor XA inhibitors | MERCK PATENT GMBH (DE) | 2002-12-10 | — | — | US | disclosed |