Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MELK | Q14680 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.36 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.36 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.36 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL81322 | 0.76 | MELK (0.46) | MMP2MMP12ALDH1A1HTTMELK | |
| SCHEMBL17733479 | 0.73 | MELK (0.41) | MMP2MMP12ALDH1A1MELKGRIK1 | |
| SCHEMBL1310828 | 0.72 | GABRP (0.36) | MEN1KMT2ACYP1A2 | |
| SCHEMBL81541 | 0.71 | MELK (0.42) | KMT2AMMP2MMP12SMN1; SMN2ALDH1A1 | |
| SCHEMBL13531864 | 0.71 | MELK (0.42) | KMT2AMMP2MMP12SMN1; SMN2ALDH1A1 | |
| SCHEMBL15099419 | 0.70 | CTDSP1 (0.42) | MMP2MMP12SMN1; SMN2MELKL3MBTL1 | |
| SCHEMBL8048607 | 0.70 | SLC1A3 (0.53) | MEN1KMT2ASMN1; SMN2ALDH1A1HTT | |
| SCHEMBL2091371 | 0.70 | MEN1 (0.71) | MEN1KMT2ASMN1; SMN2ALDH1A1HTT | |
| SCHEMBL11118946 | 0.69 | GPR174 (0.59) | MEN1KMT2ASMN1; SMN2ALDH1A1HTT | |
| SCHEMBL8105989 | 0.69 | MELK (0.44) | MMP2MMP12ALDH1A1MELKGRIK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021050547-A1 | MITOCHONDRIAL COMPLEX I INHIBITORS AND METHODS OF USE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-03-18 | — | — | WO | disclosed |