Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11090304 | 0.76 | GSK3B (0.51) | KDM4ECYP1A2JAK1LMNACYP2C19 | |
| SCHEMBL11113610 | 0.73 | ALDH1A1 (0.50) | GAAMAPTKDM4EHTTCYP1A2 | |
| SCHEMBL11119211 | 0.71 | KMT2A (0.56) | KDM4ECYP1A2ALDH1A1KMT2AHPGD | |
| SCHEMBL11248864 | 0.70 | GAA (0.42) | GAAMAPTSMN1; SMN2NPC1KDM4E | |
| SCHEMBL10842702 | 0.70 | CYP1A2 (0.40) | GAASMN1; SMN2KDM4ECYP1A2JAK1 | |
| SCHEMBL11104871 | 0.70 | KDM4E (0.53) | GAAMAPTSMN1; SMN2NPC1KDM4E | |
| SCHEMBL10857043 | 0.69 | KDM4E (0.48) | GAAMAPTSMN1; SMN2NPC1KDM4E | |
| SCHEMBL4928504 | 0.66 | KDM4E (0.47) | GAAMAPTSMN1; SMN2KDM4ECYP1A2 | |
| SCHEMBL5935763 | 0.65 | — | — | |
| SCHEMBL3184818 | 0.64 | KDM4E (0.49) | GAAMAPTSMN1; SMN2NPC1KDM4E |
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-0109628-A1 | 2(1H)-pyridinones and preparation, useful as cardiotonics | STERLING DRUG INC. (US) | 1984-05-30 | — | — | EP | disclosed |