Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | GPX4 | P36969 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7630480 | 0.81 | RECQL (0.57) | ALDH1A1KDM4EHPGDSMN1; SMN2HTT | |
| SCHEMBL4787559 | 0.80 | POLB (0.61) | ALDH1A1KDM4EMAPTLMNAMAPK1 | |
| SCHEMBL15058294 | 0.77 | POLB (0.50) | SMN1; SMN2HTTL3MBTL1POLBAPEX1 | |
| SCHEMBL6052408 | 0.77 | TDP1 (0.50) | ALDH1A1KDM4EHPGDLMNAL3MBTL1 | |
| SCHEMBL20917138 | 0.77 | POLB (0.50) | ALDH1A1KDM4ESMN1; SMN2MAPTHTT | |
| SCHEMBL16569417 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDL3MBTL1POLB | |
| SCHEMBL4960652 | 0.75 | POLB (0.47) | ALDH1A1CA2L3MBTL1POLBAPEX1 | |
| SCHEMBL22718116 | 0.74 | RAB9A (0.64) | ALDH1A1CA1CA2KDM4EHPGD | |
| SCHEMBL4540045 | 0.74 | L3MBTL1 (0.50) | ALDH1A1KDM4EHPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL7631926 | 0.73 | POLB (0.46) | ALDH1A1MAPTMAPK1HTTL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2475660-A1 | PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK | GlaxoSmithKline LLC (US) | 2012-07-18 | — | — | EP | disclosed |
| WO-2011029855-A1 | PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK | GLAXOSMITHKLINE LLC (US) | 2011-03-17 | — | — | WO | disclosed |