Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 2/20 | 0.51 |
| ▸ | GRM5 | P41594 | 5/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29289285 | 0.81 | TLR7 (0.58) | NPC1PKMRAB9ASMN1; SMN2CES1 | |
| SCHEMBL29390740 | 0.80 | KMT2A (0.56) | NPC1PKMRAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL25236791 | 0.80 | KMT2A (0.56) | NPC1PKMRAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL3836551 | 0.80 | KMT2A (0.66) | NPC1PKMRAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL10824241 | 0.80 | KMT2A (0.59) | NPC1PKMRAB9ASMN1; SMN2CES1 | |
| SCHEMBL1794480 | 0.78 | PARP1 (0.56) | NPC1PKMRAB9ASMN1; SMN2KDR | |
| SCHEMBL17842349 | 0.78 | NPC1 (0.54) | NPC1PKMRAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL9335195 | 0.78 | PRSS1 (0.44) | NPC1PKMRAB9ACES1KDR | |
| SCHEMBL17842351 | 0.78 | NPC1 (0.54) | NPC1PKMRAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL993581 | 0.77 | KDR (0.64) | GRM4HDAC6CES1KDRKCNK3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002072567-A2 | HETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLENMARK PHARMACEUTICALS LIMITED (IN) | 2002-09-19 | — | — | WO | disclosed |