Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | FABP7 | O15540 | 1/20 | 0.50 |
| ▸ | FABP3 | P05413 | 1/20 | 0.50 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL6667027 | 0.86 | KMT2A (0.53) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL55636 | 0.85 | TDP1 (0.52) | KDM4ERAB9ATDP1MAPTHSD17B10 | |
| SCHEMBL17714039 | 0.84 | KMT2A (0.55) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL233643 | 0.84 | KMT2A (0.55) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL236824 | 0.84 | KMT2A (0.55) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL27957263 | 0.84 | KMT2A (0.55) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL2760661 | 0.84 | KMT2A (0.55) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| Water SCHEMBL27809339 | 0.83 | TDP1 (0.50) | KDM4ERAB9ATDP1MAPTHSD17B10 | |
| SCHEMBL246849 | 0.82 | KMT2A (0.53) | KMT2AMEN1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL29399270 | 0.80 | HSD17B10 (0.71) | KMT2AMEN1SMN1; SMN2LMNANPSR1 |
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-1021403-B1 | 2,3-DIOXABICYCLO 3.3.1]NONANE DERIVATIVES AND ANTIMALARIAL PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | YEDA RES & DEV (IL) | 2005-04-20 | — | — | EP | claimed |
| US-6166065-A | 2,3-dioxabicyclo[3.3.1]nonane derivatives and antimalarial pharmaceutical compositions comprising them | YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) | 2000-12-26 | — | — | US | claimed |