Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.57 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | VCP | P55072 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.50 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.50 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.50 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | PAM | P19021 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Diphenylacetylene SCHEMBL168884 | 0.84 | APP (0.75) | NPSR1APPNPC1RAB9AMEN1 | |
| SCHEMBL124863 | 0.82 | NPSR1 (0.55) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL8103677 | 0.82 | NPSR1 (0.59) | NPSR1APPVCPNPC1RAB9A | |
| Benzene SCHEMBL28174766 | 0.82 | NPSR1 (0.59) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL68968 | 0.82 | NPSR1 (0.59) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL3346483 | 0.82 | NPSR1 (0.59) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL777600 | 0.81 | NPSR1 (0.53) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL18530660 | 0.80 | NPSR1 (0.57) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL17957122 | 0.80 | NPSR1 (0.57) | NPSR1APPVCPNPC1RAB9A | |
| SCHEMBL6553632 | 0.80 | NPSR1 (0.57) | NPSR1APPVCPNPC1RAB9A |
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-3130594-A1 | PHOSPHONATES OF ACETYLENIC BETULIN DERIVATIVES WITH ANTICANCER ACTIVITY, METHOD FOR THEIR PRODUCTION AND THEIR APPLICATION | Slaski Uniwersytet Medyczny w Katowicach (PL) | 2017-02-15 | — | — | EP | claimed |
| EP-3130594-A1 | PHOSPHONATES OF ACETYLENIC BETULIN DERIVATIVES WITH ANTICANCER ACTIVITY, METHOD FOR THEIR PRODUCTION AND THEIR APPLICATION | Slaski Uniwersytet Medyczny w Katowicach (PL) | 2017-02-15 | — | — | EP | disclosed |