Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 3/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | PPARD | Q03181 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6555882 | 0.96 | MEN1 (0.52) | MEN1KMT2ASMN1; SMN2BLMPPARA | |
| SCHEMBL6555917 | 0.95 | ALDH1A1 (0.55) | MEN1KMT2ASMN1; SMN2BLMPPARA | |
| SCHEMBL6556021 | 0.93 | PPARA (0.59) | MEN1KMT2APPARAPPARGPPARD | |
| SCHEMBL6555868 | 0.93 | SMN1; SMN2 (0.47) | MEN1KMT2ASMN1; SMN2BLMPPARA | |
| SCHEMBL6555785 | 0.89 | PPARA (0.55) | MEN1KMT2ASMN1; SMN2BLMPPARA | |
| SCHEMBL6555798 | 0.89 | KDM4E (0.59) | SMN1; SMN2PPARAPPARGPPARDALDH1A1 | |
| SCHEMBL6557882 | 0.88 | KDM4E (0.44) | MEN1KMT2ASMN1; SMN2BLMPPARA | |
| SCHEMBL6556015 | 0.88 | ALDH1A1 (0.56) | MEN1KMT2APPARAPPARGPPARD | |
| SCHEMBL6556037 | 0.86 | PPARA (0.51) | MEN1KMT2ASMN1; SMN2PPARAPPARG | |
| SCHEMBL6555796 | 0.85 | PPARA (0.53) | SMN1; SMN2PPARAPPARGPPARDALDH1A1 |
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-1073643-B1 | NEW HETEROCYCLIC COMPOUNDS AND THEIR USE IN MEDICINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | REDDYS LAB LTD DR (IN) | 2004-12-29 | — | — | EP | claimed |