Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL22569916 | 0.85 | LMNA (0.56) | CYP3A4TSHRLMNAMAPT | |
| SCHEMBL15084444 | 0.85 | LMNA (0.56) | CYP3A4TSHRLMNAMAPT | |
| SCHEMBL28460059 | 0.76 | PKM (0.51) | TSHRIDO1AGXTTRPV6CA1 | |
| SCHEMBL9618007 | 0.76 | PKM (0.51) | TSHRIDO1AGXTTRPV6CA1 | |
| SCHEMBL9234580 | 0.76 | PKM (0.51) | TSHRIDO1AGXTTRPV6CA1 | |
| SCHEMBL24114701 | 0.74 | TDP1 (0.51) | LMNAIDO1AGXT | |
| SCHEMBL18236136 | 0.71 | LMNA (0.44) | CYP3A4TSHRLMNAGRM2ALDH1A1 | |
| SCHEMBL13408694 | 0.71 | SMN1; SMN2 (0.51) | TSHRLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL16770103 | 0.71 | SMN1; SMN2 (0.51) | TSHRLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL16686216 | 0.70 | IDO1 (0.43) | CYP3A4TSHRIDO1AGXTTRPV6 |
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-2018049534-A1 | NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT | LCB PHARMA INC. (CA) | 2018-03-22 | — | — | WO | disclosed |