Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EBP | Q15125 | 5/20 | 0.61 |
| ▸ | DHCR7 | Q9UBM7 | 5/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 9/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL22032774 | 0.84 | ALDH1A1 (0.62) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL22032742 | 0.82 | ALDH1A1 (0.63) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL28079095 | 0.81 | EBP (0.57) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL5963420 | 0.80 | EPHX2 (0.60) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL31212435 | 0.79 | EBP (0.70) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL22033930 | 0.79 | EBP (0.67) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL31212431 | 0.79 | EBP (0.70) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL22032760 | 0.78 | EBP (0.61) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL20306068 | 0.78 | EBP (0.61) | EBPDHCR7NPSR1EPHX2ALDH1A1 | |
| SCHEMBL22033858 | 0.78 | EPHX2 (0.62) | EBPDHCR7NPSR1EPHX2ALDH1A1 |
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-2153832-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |
| US-6184232-B1 | AMINE ADDUCT WHICH COMPETETIVELY BINDS WITH TARGET CELL COUNTERION AND FUNCTIONS DIFFERENTLY COMPARED TO NATURAL INTRACELLULAR POLYAMINES; ANTICARCINOGENIC AGENTS | UNIVERSITY OF FLORIDA | 2001-02-06 | — | — | US | disclosed |