Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | EGFR | P00533 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.49 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.48 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.48 |
| ▸ | RELA | Q04206 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8675616 | 0.90 | MAOB (0.60) | NR1H4MAOBEGFRNPC1RAB9A | |
| SCHEMBL8675617 | 0.90 | MAOB (0.60) | NR1H4MAOBEGFRNPC1RAB9A | |
| SCHEMBL8676691 | 0.90 | MAOB (0.60) | NR1H4MAOBEGFRNPC1RAB9A | |
| SCHEMBL11293541 | 0.78 | LMNA (0.67) | MAOBRAB9ASMN1; SMN2ALOX5NR4A1 | |
| Ethylene SCHEMBL27940790 | 0.75 | LMNA (0.62) | MAOBRAB9ASMN1; SMN2ALOX5NR4A1 | |
| SCHEMBL7904469 | 0.74 | ESR1 (0.45) | NPC1RAB9ASMN1; SMN2RELANFKB1 | |
| SCHEMBL9837797 | 0.74 | KDM4E (0.66) | NR1H4MAOBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9839479 | 0.74 | KDM4E (0.66) | NR1H4MAOBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9839473 | 0.74 | KDM4E (0.66) | NR1H4MAOBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11442507 | 0.74 | EGFR (0.53) | NR1H4MAOBEGFRNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997004778-A1 | PYRIDINE COMPOUNDS, INTERMEDIATES, PROCESSES, COMPOSITIONS, AND METHODS | ELI LILLY AND COMPANY (US) | 1997-02-13 | — | — | WO | disclosed |