Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.53 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7074627 | 0.88 | TSHR (0.57) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL8076014 | 0.88 | DGAT1 (0.46) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7069910 | 0.85 | MGLL (0.52) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7069975 | 0.84 | GAA (0.60) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7074862 | 0.83 | DGAT1 (0.53) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7076669 | 0.83 | GAA (0.53) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7075151 | 0.82 | HDAC4 (0.49) | HDAC4HDAC6DGAT1LMNAMAPK1 | |
| SCHEMBL7074575 | 0.81 | HDAC4 (0.48) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7071584 | 0.81 | GAA (0.52) | HDAC4HDAC6DGAT1LMNATSHR | |
| SCHEMBL7074013 | 0.81 | HDAC4 (0.56) | HDAC4HDAC6DGAT1LMNATSHR |
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 |