Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.67 |
| ▸ | GAA | P10253 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | GLA | P06280 | 2/20 | 0.67 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.64 |
| ▸ | MEN1 | O00255 | 5/20 | 0.64 |
| ▸ | POLB | P06746 | 3/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | CASP6 | P55212 | 1/20 | 0.64 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.58 |
| ▸ | CTSV | O60911 | 1/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL14598929 | 0.96 | KDM4E (0.62) | KDM4EGAAALDH1A1GLAHTT | |
| SCHEMBL31490922 | 0.90 | LMNA (0.60) | KDM4EGAAALDH1A1GLAHTT | |
| SCHEMBL4231006 | 0.89 | GAA (0.67) | KDM4EGAAALDH1A1GLAHTT | |
| SCHEMBL14543826 | 0.87 | PARP1 (0.59) | KDM4EGAAALDH1A1GLAHTT | |
| SCHEMBL29354683 | 0.86 | LMNA (0.56) | KDM4EGAAALDH1A1LMNAHPGD | |
| SCHEMBL276018 | 0.86 | LMNA (0.56) | KDM4EGAAALDH1A1LMNAHPGD | |
| SCHEMBL29586622 | 0.86 | LMNA (0.56) | KDM4EGAAALDH1A1LMNAHPGD | |
| SCHEMBL7342186 | 0.86 | PARP1 (0.54) | KDM4EALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL7334274 | 0.84 | PARP1 (0.57) | KDM4EGAAALDH1A1GLAHTT | |
| Hydrochloric Acid SCHEMBL8819543 | 0.84 | PARP1 (0.53) | KDM4EALDH1A1LMNAKMT2AMEN1 |
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-2705550-B1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2017-07-05 | — | — | EP | disclosed |
| WO-2012149999-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-11-08 | — | — | WO | disclosed |