Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | KMO | O15229 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.51 |
| ▸ | FEN1 | P39748 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27534511 | 0.86 | SLC7A5 (0.56) | NPC1RAB9AKMOHDAC8ERCC5 | |
| SCHEMBL6139471 | 0.85 | CYP4F2 (0.49) | NPC1RAB9ATDP1KDM4EALDH1A1 | |
| SCHEMBL2404818 | 0.84 | NPC1 (0.59) | NPC1RAB9AMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL21312288 | 0.83 | TDP1 (0.59) | NPC1RAB9AKMOERCC5FEN1 | |
| SCHEMBL13291800 | 0.83 | KDM4E (0.66) | NPC1RAB9AMAPTTDP1KDM4E | |
| SCHEMBL32664886 | 0.83 | RAB9A (0.75) | NPC1RAB9AKMOMAPTTDP1 | |
| SCHEMBL27957337 | 0.83 | RAB9A (0.75) | NPC1RAB9AKMOMAPTTDP1 | |
| SCHEMBL27700823 | 0.83 | CYP4F2 (0.47) | NPC1RAB9ATDP1KDM4E | |
| SCHEMBL593826 | 0.82 | TDP1 (0.65) | NPC1RAB9ATDP1KDM4EALDH1A1 | |
| SCHEMBL343889 | 0.82 | TDP1 (0.65) | NPC1RAB9ATDP1KDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1938323-A | Silinane compounds as cysteine protease inhibitors | SCHERING AG (DE) | 2007-03-28 | — | — | CN | claimed |
| CN-101426786-A | Benzazole potentiators of metabotropic glutamate receptors | MERCK & CO INC (US) | 2009-05-06 | — | — | CN | disclosed |
| CN-1938323-A | Silinane compounds as cysteine protease inhibitors | SCHERING AG (DE) | 2007-03-28 | — | — | CN | disclosed |