Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27550449 | 0.96 | MAPK1 (0.58) | MAPK1ALDH1A1PKMTSHRLMNA | |
| SCHEMBL7075147 | 0.87 | RAB9A (0.60) | MAPK1ALDH1A1PKMTSHRLMNA | |
| SCHEMBL7074220 | 0.81 | LMNA (0.71) | MAPK1ALDH1A1LMNAGAAKMT2A | |
| SCHEMBL7069901 | 0.79 | KDM4E (0.72) | MAPK1ALDH1A1PKMTSHRLMNA | |
| SCHEMBL5735712 | 0.79 | MAPK1 (0.57) | MAPK1ALDH1A1PKMTSHRLMNA | |
| Acetic Acid SCHEMBL28744327 | 0.78 | LMNA (0.70) | ALDH1A1LMNAGAASMN1; SMN2KMT2A | |
| SCHEMBL7070294 | 0.77 | GAA (0.56) | MAPK1ALDH1A1TSHRLMNAGAA | |
| SCHEMBL7069417 | 0.77 | HPGD (0.68) | MAPK1ALDH1A1TSHRLMNASMN1; SMN2 | |
| SCHEMBL7071445 | 0.77 | F10 (0.62) | MAPK1ALDH1A1TSHRLMNAGAA | |
| Acetic Acid SCHEMBL27568113 | 0.76 | GAA (0.56) | MAPK1ALDH1A1TSHRLMNAGAA |
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 |