Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | ERN1 | O75460 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CHAT | P28329 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29708066 | 0.84 | MAPT (0.54) | ALDH1A1ERN1LMNAMAPTTSHR | |
| SCHEMBL545661 | 0.84 | MAPT (0.54) | ALDH1A1ERN1LMNAMAPTTSHR | |
| SCHEMBL2651067 | 0.76 | GCGR (0.53) | TYRALDH1A1LMNAMAPTHPGD | |
| Acrylic Acid SCHEMBL11696395 | 0.75 | CAPN1 (0.50) | ERN1LMNAMAPTBACE1CAPN1 | |
| SCHEMBL31362059 | 0.74 | ERN1 (0.61) | ALDH1A1ERN1LMNAMAPTNFE2L2 | |
| SCHEMBL2988767 | 0.74 | ERN1 (0.61) | ALDH1A1ERN1LMNAMAPTNFE2L2 | |
| Cuminaldehyde SCHEMBL4109069 | 0.74 | TYR (0.83) | TYRALDH1A1LMNAKMT2ASMN1; SMN2 | |
| Cuminaldehyde SCHEMBL87226 | 0.74 | TYR (1.00) | TYRALDH1A1 | |
| Cuminaldehyde SCHEMBL719761 | 0.74 | TYR (1.00) | TYRALDH1A1 | |
| SCHEMBL7710242 | 0.74 | MCL1 (0.48) | ALDH1A1ERN1LMNAMAPTCAPN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1189891-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION Bioscience AG (DE) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000594-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2001-01-04 | — | — | WO | disclosed |