Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20469753 | 0.95 | CETP (0.42) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469761 | 0.95 | CETP (0.42) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL23542086 | 0.91 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469792 | 0.88 | CETP (0.40) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469713 | 0.88 | CETP (0.40) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469757 | 0.87 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20455769 | 0.87 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20455800 | 0.87 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469797 | 0.85 | CETP (0.42) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 | |
| SCHEMBL20469793 | 0.84 | CETP (0.42) | SMN1; SMN2ALDH1A1NPSR1LMNAUSP2 |
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-2018141854-A1 | PIPERAZINE DERIVATIVES FOR INFLUENZA VIRUS INHIBITION | JANSSEN VACCINES & PREVENTION B.V. (NL) | 2018-08-09 | — | — | WO | disclosed |