Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.59 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | VCAM1 | P19320 | 5/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11887848 | 0.80 | DHFR (0.52) | DHFRNCOA1NCOA3MAPTMEN1 | |
| SCHEMBL5992360 | 0.79 | VCAM1 (0.60) | DHFRMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL4096354 | 0.78 | DHFR (0.68) | DHFRNCOA1NCOA3MAPTMEN1 | |
| SCHEMBL9566549 | 0.78 | PDGFRB (0.57) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL4088964 | 0.78 | MAPT (0.56) | DHFRMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL9485648 | 0.77 | NCOA1 (0.72) | DHFRNCOA1NCOA3MAPTMEN1 | |
| SCHEMBL27612645 | 0.77 | DHFR (0.60) | DHFRNCOA1NCOA3MAPTMEN1 | |
| SCHEMBL2461199 | 0.77 | VCAM1 (0.58) | DHFRMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL9566581 | 0.76 | RAB9A (1.00) | DHFRNPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL1388763 | 0.76 | DHFR (1.00) | DHFRNCOA1NCOA3MAPTMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |