Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PRKCB | P05771 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21648535 | 1.00 | CHRNA7 (0.42) | CHRNA7ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL21648536 | 1.00 | CHRNA7 (0.42) | CHRNA7ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL21648505 | 0.85 | MAPKAPK2 (0.46) | ADRA1DADRA1ACYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL21648537 | 0.85 | MAPKAPK2 (0.46) | ADRA1DADRA1ACYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL21648540 | 0.85 | MAPKAPK2 (0.46) | ADRA1DADRA1ACYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL21648522 | 0.79 | CHRNA7 (0.45) | CHRNA7ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL21648521 | 0.79 | CHRNA7 (0.45) | CHRNA7ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL21648554 | 0.78 | MEN1 (0.53) | PDE5ATSHRHTTMEN1KMT2A | |
| SCHEMBL21648510 | 0.77 | CHRNA7 (0.43) | CHRNA7ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL21648542 | 0.77 | CHRNA7 (0.43) | CHRNA7ADRA1DADRA1AADRA1BPOLB |
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-2020021489-A2 | DISCOVERY OF NOVEL FIRST IN CLASS NATURE-INSPIRED COMPOUNDS TARGETING THE MITOCHONDRIAL FUNCTION AND PHARMACEUTICAL COMPOSITION THEREOF | UNIVERSITY OF SHARJAH (AE) | 2020-01-30 | — | — | WO | disclosed |