Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11066647 | 0.88 | ALDH1A1 (0.45) | ALDH1A1GAASMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL11068470 | 0.80 | ALDH1A1 (0.43) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL2707041 | 0.78 | ALDH1A1 (0.56) | ALDH1A1GAASMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL11064170 | 0.73 | HTT (0.46) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL1206436 | 0.72 | ALDH1A1 (0.66) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL17202783 | 0.71 | ALDH1A1 (0.54) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL15591257 | 0.71 | ALDH1A1 (0.54) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL1523174 | 0.70 | ALDH1A1 (0.67) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL18602324 | 0.70 | ALDH1A1 (0.53) | ALDH1A1GAASMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL11107308 | 0.70 | ALDH1A1 (0.53) | ALDH1A1GAASMN1; SMN2HTTL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4440779-A | Tricyclic derivatives of substituted pyrrole acids as analgesic and anti-inflammatory agents | MERCK & CO., INC. (US) | 1984-04-03 | — | — | US | disclosed |
| EP-0068460-A1 | Tricyclic derivatives of substituted pyrrole acids as analgesic and anti-inflammatory agents | MERCK & CO. INC. (US) | 1983-01-05 | — | — | EP | disclosed |