Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | APEX1 | P27695 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19359279 | 0.86 | TP53 (0.52) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL17237483 | 0.84 | TP53 (0.48) | TP53LMNAALDH1A1POLBKDM4E | |
| SCHEMBL11929784 | 0.84 | TP53 (0.48) | TP53LMNAALDH1A1POLBKDM4E | |
| SCHEMBL30299438 | 0.82 | TP53 (0.67) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL542855 | 0.82 | TP53 (0.67) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL511872 | 0.82 | TP53 (0.67) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL1171070 | 0.82 | TP53 (0.67) | TP53LMNAALDH1A1GAAPOLB | |
| N Phthaloyl-L-Threonine SCHEMBL5424529 | 0.80 | TP53 (0.56) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL125972 | 0.74 | LMNA (0.71) | TP53LMNAALDH1A1GAAPOLB | |
| SCHEMBL19588472 | 0.74 | TDP1 (0.62) | TP53LMNAALDH1A1GAAPOLB |
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-2493843-B1 | 2-AMINO-3-METHYL-HEX-5-ENOIC ACID AND ITS USE IN THE PRODUCTION OF PEPTIDES SUCH AS BACITRACINS | XELLIA PHARMACEUTICALS APS (DK) | 2015-11-11 | — | — | EP | claimed |