Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.43 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4819924 | 0.78 | RAPGEF4 (0.53) | RAPGEF4NPC1MEN1KMT2ARAB9A | |
| SCHEMBL12593865 | 0.78 | NPC1 (0.60) | NPC1MEN1KMT2ARAB9AMAPT | |
| SCHEMBL14882198 | 0.77 | NPC1 (0.42) | NPC1MEN1KMT2ARORCGAA | |
| SCHEMBL28128281 | 0.76 | HSD17B10 (0.51) | RAPGEF4NPC1MEN1KMT2ARORC | |
| SCHEMBL14880926 | 0.74 | ALDH1A1 (0.46) | NPC1MEN1KMT2AGAAHSD17B10 | |
| SCHEMBL14880646 | 0.74 | MEN1 (0.62) | NPC1MEN1KMT2AGAARAB9A | |
| SCHEMBL22074675 | 0.73 | HSD17B10 (0.61) | NPC1MEN1KMT2ARORCGAA | |
| SCHEMBL14881104 | 0.72 | KMT2A (0.59) | NPC1MEN1KMT2AGAARAB9A | |
| SCHEMBL14881170 | 0.72 | MEN1 (0.46) | NPC1MEN1KMT2AGAARAB9A | |
| SCHEMBL14881154 | 0.70 | ALDH1A1 (0.71) | NPC1MEN1KMT2AGAAHSD17B10 |
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-2013056679-A1 | NOVEL HETEROARYL-AMINO DERIVATIVES | BEIJING HANMI PHARMACEUTICAL CO., LTD (CN) | 2013-04-25 | — | — | WO | disclosed |