Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 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 | |
|---|---|---|---|---|
| SCHEMBL26581441 | 0.90 | KDM4E (0.52) | SMN1; SMN2GAAKDM4EALDH1A1TP53 | |
| SCHEMBL23809486 | 0.85 | MEN1 (0.50) | SMN1; SMN2GAAKDM4EALDH1A1TP53 | |
| SCHEMBL23809503 | 0.80 | KDM4E (0.46) | KDM4EALDH1A1 | |
| SCHEMBL23809167 | 0.75 | KDM4E (0.52) | GAAKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL7290826 | 0.73 | THRB (0.62) | SMN1; SMN2GAAKDM4EALDH1A1TP53 | |
| SCHEMBL25564552 | 0.72 | ALDH1A1 (0.62) | SMN1; SMN2GAAKDM4EALDH1A1NPC1 | |
| SCHEMBL23809314 | 0.72 | KDM4E (0.41) | KDM4EALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL16533933 | 0.71 | KDM4E (0.57) | SMN1; SMN2GAAKDM4EALDH1A1TP53 | |
| SCHEMBL15720776 | 0.71 | ALDH1A1 (0.60) | SMN1; SMN2GAAKDM4EALDH1A1TP53 | |
| SCHEMBL7281072 | 0.70 | KDM4E (0.63) | SMN1; SMN2GAAKDM4EALDH1A1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3423435-B1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | UNIV VANDERBILT (US) | 2023-08-23 | — | — | EP | disclosed |