Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.73 |
| ▸ | RAB9A | P51151 | 6/20 | 0.73 |
| ▸ | LMNA | P02545 | 3/20 | 0.71 |
| ▸ | HTT | P42858 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL224315 | 0.90 | NPC1 (0.83) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL2330447 | 0.88 | SMN1; SMN2 (0.71) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL2334429 | 0.84 | NPC1 (0.67) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL2538729 | 0.83 | SMN1; SMN2 (1.00) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL13975630 | 0.82 | RAB9A (0.71) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL25410220 | 0.81 | NPC1 (0.73) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL14157008 | 0.80 | NPC1 (0.55) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL4771241 | 0.79 | SMN1; SMN2 (0.67) | NPC1SMN1; SMN2RAB9ALMNAHTT | |
| SCHEMBL9320954 | 0.78 | RXRA (0.71) | — | |
| SCHEMBL1346046 | 0.78 | SMN1; SMN2 (0.64) | NPC1SMN1; SMN2RAB9ALMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012170371-A1 | COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | N30 PHARMACEUTICALS, LLC (US) | 2012-12-13 | — | — | WO | disclosed |
| WO-2011099978-A1 | CHROMONE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE | N30 PHARMACEUTICALS, LLC (US) | 2011-08-18 | — | — | WO | disclosed |