Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11264480 | 0.78 | KMT2A (0.60) | SMN1; SMN2GAACES2CES1ALDH1A1 | |
| SCHEMBL11267948 | 0.73 | MAPT (0.51) | SMN1; SMN2GAAALDH1A1NPC1MAPT | |
| SCHEMBL11266631 | 0.72 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1HPGDRAB9APTPN1 | |
| SCHEMBL11275005 | 0.71 | MAOB (0.61) | SMN1; SMN2ALDH1A1HPGDKDM4EHTT | |
| SCHEMBL28308753 | 0.70 | GAA (0.52) | SMN1; SMN2GAACES2CES1ALDH1A1 | |
| SCHEMBL11260263 | 0.70 | SMN1; SMN2 (0.44) | SMN1; SMN2GAACES2CES1ALDH1A1 | |
| SCHEMBL11273012 | 0.70 | MAPT (0.47) | SMN1; SMN2CES2CES1ALDH1A1NPC1 | |
| SCHEMBL13626304 | 0.69 | ALDH1A1 (0.51) | SMN1; SMN2GAACES2CES1ALDH1A1 | |
| SCHEMBL21916345 | 0.69 | CES2 (0.48) | SMN1; SMN2GAACES2CES1ALDH1A1 | |
| SCHEMBL11259579 | 0.69 | PAM (0.62) | GAACES2CES1ALDH1A1HPGD |
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-4329363-A | Substituted mercapto acid amides and their use | MERCK & CO., INC. (US) | 1982-05-11 | — | — | US | disclosed |
| US-4216160-A | IMMUNOREGULANTS FOR CORRECTING AN INBALANCE OF IMMUNE HOMEOSTASIS | MERCK & CO., INC. (US) | 1980-08-05 | — | — | US | disclosed |