Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 7/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL470201 | 0.94 | TSHR (0.71) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL459690 | 0.93 | TSHR (0.70) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL12273645 | 0.90 | TSHR (0.66) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL12457361 | 0.89 | TSHR (0.65) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL10087679 | 0.89 | TSHR (0.69) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL12273583 | 0.88 | TSHR (0.65) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL470370 | 0.87 | TSHR (0.66) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL456716 | 0.87 | TSHR (0.66) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL470168 | 0.86 | TSHR (0.65) | TSHRMAPK1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL457381 | 0.85 | TSHR (0.64) | 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 |