Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28057200 | 0.80 | KEAP1 (0.39) | RECQLALDH1A1CHRM2CHRM1CHRM4 | |
| SCHEMBL664691 | 0.78 | EPHX1 (0.33) | RECQLSMN1; SMN2ALDH1A1CHRM2CHRM1 | |
| SCHEMBL14920977 | 0.76 | EPHX1 (0.33) | RECQLSMN1; SMN2ALDH1A1EPHX1KEAP1 | |
| SCHEMBL12672198 | 0.72 | SMN1; SMN2 (0.41) | RECQLCES2CES1HSD11B1NAAA | |
| SCHEMBL13899557 | 0.69 | SMN1; SMN2 (0.42) | RECQLCES2CES1HSD11B1NAAA | |
| SCHEMBL11302966 | 0.69 | EPHX1 (0.33) | NAAAALDH1A1CHRM2CHRM1EPHX1 | |
| SCHEMBL3013647 | 0.69 | KEAP1 (0.37) | RECQLNAAAALDH1A1CHRM2CHRM1 | |
| SCHEMBL8020012 | 0.68 | EPHX1 (0.33) | NAAASMN1; SMN2HSD17B10ALDH1A1CHRM2 | |
| SCHEMBL1228534 | 0.68 | CES2 (0.50) | RECQLCES2CES1HSD11B1NAAA | |
| SCHEMBL10234483 | 0.68 | CYP1A2 (0.37) | RECQLSMN1; SMN2ALDH1A1CHRM2CHRM1 |
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-0416373-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1991-03-13 | — | — | EP | disclosed |