Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL470469 | 0.89 | TSHR (0.52) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL16374973 | 0.89 | TSHR (0.51) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL16374952 | 0.89 | TSHR (0.51) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL10087686 | 0.86 | TSHR (0.56) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL12523352 | 0.85 | TSHR (0.54) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL12457258 | 0.83 | TSHR (0.49) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL470304 | 0.79 | TSHR (0.51) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL470242 | 0.79 | TSHR (0.49) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL457864 | 0.78 | TSHR (0.55) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL10087685 | 0.78 | TSHR (0.55) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 |
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-2012033736-A1 | NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-15 | — | — | WO | disclosed |