Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | APLNR | P35414 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4833441 | 0.88 | FAAH (0.37) | FAAHCYP26A1ALDH1A1HPGD | |
| SCHEMBL4833715 | 0.88 | ATM (0.36) | FAAHKDM4EALDH1A1 | |
| SCHEMBL4839775 | 0.86 | TEAD1 (0.37) | FAAHCYP26A1 | |
| SCHEMBL7725820 | 0.81 | TSPO (0.37) | ALDH1A1 | |
| SCHEMBL7725794 | 0.80 | L3MBTL1 (0.38) | CYP26A1KEAP1NFE2L2PKMTP53 | |
| SCHEMBL18568034 | 0.79 | KDM4E (0.32) | FAAHKDM4EALDH1A1 | |
| SCHEMBL7724591 | 0.79 | ALOX5 (0.38) | CYP26A1KEAP1NFE2L2ALOX5PKM | |
| SCHEMBL7730042 | 0.76 | MMP2 (0.38) | KEAP1NFE2L2PKMRAB9A | |
| SCHEMBL15049932 | 0.75 | ADRB2 (0.38) | KDM4EALDH1A1 | |
| SCHEMBL29529432 | 0.75 | ADRB2 (0.38) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6403818-B1 | ONE POT PROCESS STARTING FROM CARBONYL COMPOUND, ALCOHOL, THIOL OR AMINE, AND PROTECTED HYDROXYDICYANO COMPOUND | EISAI CO., LTD. (JP) | 2002-06-11 | — | — | US | disclosed |