Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.56 |
| ▸ | F10 | P00742 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | PLG | P00747 | 1/20 | 0.53 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.53 |
| ▸ | MC4R | P32245 | 1/20 | 0.52 |
| ▸ | MC5R | P33032 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.52 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
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 SCHEMBL27550435 | 0.95 | ALDH1A1 (0.57) | KDM4EALDH1A1SLC2A1F10PKM | |
| SCHEMBL7075145 | 0.90 | F10 (0.54) | KDM4EALDH1A1F10LMNASMN1; SMN2 | |
| SCHEMBL7069988 | 0.88 | F10 (0.59) | KDM4EALDH1A1F10PKMMEN1 | |
| Acetic Acid SCHEMBL27568116 | 0.86 | F10 (0.52) | KDM4EALDH1A1F10LMNASMN1; SMN2 | |
| SCHEMBL8003156 | 0.84 | F10 (0.61) | F10PKMMEN1KMT2ARAB9A | |
| SCHEMBL7074669 | 0.84 | TSHR (0.56) | KDM4EALDH1A1LMNASMN1; SMN2TSHR | |
| SCHEMBL7074428 | 0.84 | PKM (0.62) | ALDH1A1F10PKMMEN1KMT2A | |
| SCHEMBL10224782 | 0.83 | HDAC1 (0.61) | KDM4EALDH1A1SLC2A1PKMMEN1 | |
| Hydrochloric Acid SCHEMBL6896958 | 0.83 | F10 (0.61) | F10PKMMEN1KMT2ARAB9A | |
| SCHEMBL7069999 | 0.83 | MC4R (0.72) | PKMMEN1KMT2APLGMC4R |
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 4 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 |
| EP-1025086-A1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GmbH (DE) | 2000-08-09 | — | — | EP | disclosed |
| WO-1999016751-A1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GMBH (DE) | 1999-04-08 | — | — | WO | disclosed |