Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 11/20 | 0.59 |
| ▸ | NPC1 | O15118 | 10/20 | 0.59 |
| ▸ | PKM | P14618 | 5/20 | 0.59 |
| ▸ | DHODH | Q02127 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
| ▸ | PIM1 | P11309 | 1/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.56 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.56 |
| ▸ | FLT3 | P36888 | 1/20 | 0.56 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.56 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL1147615 | 0.82 | NPC1 (0.63) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL14562612 | 0.80 | RAB9A (0.66) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL17667006 | 0.79 | DHODH (0.60) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL17667009 | 0.79 | DHODH (0.60) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL1185009 | 0.79 | NPC1 (0.63) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL9080412 | 0.79 | NPC1 (0.63) | RAB9ANPC1PKMDHODHGAA | |
| Formic Acid SCHEMBL28791825 | 0.78 | NPC1 (0.58) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL519066 | 0.77 | RAB9A (0.73) | RAB9ANPC1PKMGAAKMT2A | |
| SCHEMBL14404856 | 0.76 | DHODH (0.60) | RAB9ANPC1PKMDHODHGAA | |
| SCHEMBL28711768 | 0.76 | EGFR (0.55) | RAB9ANPC1PKMDHODHGAA |
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-0815108-A1 | CYCLIC UREA HIV PROTEASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-01-07 | — | — | EP | claimed |