Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KCNA5 | P22460 | 8/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL2210472 | 0.85 | HPGD (0.62) | HPGDSMN1; SMN2NPC1RAB9AKCNA5 | |
| SCHEMBL31055402 | 0.84 | HPGD (0.54) | HPGDSMN1; SMN2NPC1RAB9AKCNA5 | |
| SCHEMBL1855523 | 0.81 | MAPK1 (0.54) | HPGDKMT2AHTTL3MBTL1MEN1 | |
| SCHEMBL11087644 | 0.80 | NPC1 (0.63) | HPGDSMN1; SMN2NPC1RAB9AKCNA5 | |
| SCHEMBL18707026 | 0.78 | NLRP3 (0.43) | HPGDSMN1; SMN2NPC1RAB9AKMT2A | |
| SCHEMBL26833368 | 0.78 | HPGD (0.42) | HPGDNPC1RAB9AKMT2AHTT | |
| SCHEMBL22053013 | 0.76 | KMT2A (0.46) | HPGDNPC1RAB9AKMT2AHTT | |
| SCHEMBL10004813 | 0.76 | HPGD (0.52) | HPGDSMN1; SMN2NPC1RAB9AKMT2A | |
| SCHEMBL21461009 | 0.75 | CA1 (0.47) | SMN1; SMN2NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL145178 | 0.75 | GAA (0.56) | HPGDNPC1RAB9AKMT2AMEN1 |
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-118480001-A | C-Kit (V559D)/PDGFR beta double-target allosteric inhibitor and preparation method, pharmaceutical composition and application thereof | 贵州省天然产物研究中心 | 2024-08-13 | — | — | CN | disclosed |