Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NNMT | P40261 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27671785 | 0.85 | SMN1; SMN2 (0.51) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL6216992 | 0.83 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL14686821 | 0.77 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL12500156 | 0.77 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL23554282 | 0.75 | MAPT (0.55) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL4737223 | 0.75 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL29549633 | 0.75 | MAPT (0.55) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL9364170 | 0.74 | GAA (0.37) | SMN1; SMN2MAPTL3MBTL1GAACA1 | |
| SCHEMBL21041119 | 0.74 | NNMT (0.69) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL9956693 | 0.74 | RAB9A (0.62) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113461608-B | Synthetic method of 6-formyl methyl nicotinate | 江苏弘和药物研发有限公司 | 2023-03-17 | — | — | CN | disclosed |