Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL6967305 | 0.81 | OPRL1 (0.36) | ALDH1A1HTTLMNASMN1; SMN2CYP1A2 | |
| SCHEMBL6977098 | 0.81 | CYP3A4 (0.31) | TLR7NPC1LMNATP53PKM | |
| SCHEMBL6978959 | 0.78 | PTGS1 (0.42) | NPC1LMNATP53PKMRAB9A | |
| SCHEMBL6980522 | 0.73 | MPO (0.39) | KDM4EALDH1A1HRH1 | |
| SCHEMBL6974839 | 0.70 | ALDH1A1 (0.41) | KDM4EALDH1A1NPC1LMNATP53 | |
| SCHEMBL6980192 | 0.70 | PTGS1 (0.31) | SMN1; SMN2 | |
| SCHEMBL28869839 | 0.69 | HRH1 (0.51) | KDM4EALDH1A1GAAHTTTLR7 | |
| SCHEMBL6976719 | 0.68 | POLB (0.59) | — | |
| SCHEMBL6980592 | 0.67 | FFAR1 (0.33) | — | |
| SCHEMBL6976231 | 0.67 | KDM4E (0.34) | KDM4EALDH1A1GAANPC1RAB9A |
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-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | claimed |