Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13744682 | 0.82 | TSHR (0.59) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL7568606 | 0.81 | HSP90AB1 (0.55) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL7569936 | 0.80 | KMT2A (0.44) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL741180 | 0.77 | HSP90AB1 (0.50) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL28486478 | 0.77 | HSP90AB1 (0.50) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL6829600 | 0.75 | HSP90AB1 (0.49) | HSP90AB1TSHRLMNAMAPTNPC1 | |
| SCHEMBL151114 | 0.71 | — | — | |
| SCHEMBL11640161 | 0.71 | TSHR (1.00) | HSP90AB1TSHRLMNAMAPTKMT2A | |
| Ammonia Solution, Strong SCHEMBL20919221 | 0.69 | HSP90AA1 (0.56) | HSP90AB1TSHRMAPTNPC1GAA | |
| SCHEMBL30863954 | 0.69 | HSP90AA1 (0.56) | HSP90AB1TSHRMAPTNPC1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1077981-B1 | NOVEL CEPHALOSPORIN COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND ANTIMICROBIAL COMPOSITIONS CONTAINING THE SAME | LG CHEMICAL LTD (KR) | 2002-08-07 | — | — | EP | disclosed |