Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KCNJ6 | P48051 | 6/20 | 0.35 |
| ▸ | KCNJ5 | P48544 | 6/20 | 0.35 |
| ▸ | KCNJ3 | P48549 | 6/20 | 0.35 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | CTSS | P25774 | 2/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.31 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.31 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28954236 | 1.00 | NPC1 (0.40) | NPC1LMNATP53PKMRAB9A | |
| SCHEMBL31681893 | 0.73 | KDM4E (0.40) | LMNATP53RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL28989269 | 0.73 | KDM4E (0.40) | LMNATP53RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL29413782 | 0.71 | — | — | |
| SCHEMBL29413795 | 0.69 | NPC1 (0.48) | NPC1LMNATP53RAB9ASMN1; SMN2 | |
| SCHEMBL31199041 | 0.67 | MAPT (0.36) | LMNAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL30912711 | 0.67 | ALDH1A1 (0.39) | RAB9ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL29271137 | 0.67 | ALDH1A1 (0.39) | RAB9ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL29413805 | 0.67 | KDR (0.40) | NPC1LMNATP53RAB9ASMN1; SMN2 | |
| SCHEMBL29413827 | 0.66 | NPC1 (0.43) | NPC1LMNATP53RAB9ASMN1; SMN2 |
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-108558833-B | Pyrazole alcohol compound, pharmaceutical composition thereof and application thereof in medicines | 贵州医科大学 | 2022-03-04 | — | — | CN | disclosed |