Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.48 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21644716 | 1.00 | KDR (0.52) | KDRNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL21644614 | 0.89 | PABPC1 (0.53) | NPC1RAB9AMAPTSMN1; SMN2SGMS2 | |
| SCHEMBL30779645 | 0.89 | PABPC1 (0.53) | NPC1RAB9AMAPTSMN1; SMN2SGMS2 | |
| SCHEMBL21644625 | 0.87 | SGMS2 (0.47) | SGMS2LRRK2MEN1KMT2A | |
| SCHEMBL30779602 | 0.87 | SGMS2 (0.47) | SGMS2LRRK2MEN1KMT2A | |
| SCHEMBL28414824 | 0.86 | KDR (0.52) | KDRNPC1RAB9AMAPTNFKB1 | |
| SCHEMBL20509677 | 0.86 | SGMS2 (0.46) | SGMS2LRRK2MEN1KMT2A | |
| SCHEMBL30779647 | 0.86 | SGMS2 (0.46) | SGMS2LRRK2MEN1KMT2A | |
| SCHEMBL21644687 | 0.85 | SGMS2 (0.62) | NPC1RAB9AMAPTSMN1; SMN2SGMS2 | |
| SCHEMBL30779582 | 0.85 | SGMS2 (0.62) | NPC1RAB9AMAPTSMN1; SMN2SGMS2 |
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-111164074-B | Heat shock protein 90 inhibitors | 台北医学大学 | 2024-02-02 | — | — | CN | disclosed |