Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | PER2 | O15055 | 1/20 | 0.31 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.30 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.30 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2065172 | 0.89 | KDM4E (0.45) | KDM4EPIK3CDNQO2CNR1CNR2 | |
| SCHEMBL4573839 | 0.79 | NAAA (0.49) | KDM4EPIK3CDNQO2NR1H2NAAA | |
| SCHEMBL10337440 | 0.77 | KDM4E (0.42) | KDM4EPIK3CDNQO2NR1H2NAAA | |
| SCHEMBL1712876 | 0.77 | — | — | |
| SCHEMBL6284534 | 0.76 | KMT2A (0.44) | KDM4EALDH1A1LMNAPOLBMAPT | |
| SCHEMBL8157044 | 0.76 | KDM4E (0.41) | KDM4EPIK3CDNQO2NR1H2NAAA | |
| SCHEMBL16377754 | 0.76 | KDM4E (0.46) | KDM4EPIK3CDNQO2NR1H2NAAA | |
| SCHEMBL2065643 | 0.76 | KDM4E (0.50) | KDM4EPIK3CDNQO2NR1H2NAAA | |
| SCHEMBL15111451 | 0.76 | KDM4E (0.46) | KDM4EPIK3CDNQO2NAAAALDH1A1 | |
| SCHEMBL1031978 | 0.76 | KDM4E (0.46) | KDM4EPIK3CDNQO2NAAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997016425-A1 | NOVEL INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS | MERCK & CO., INC. (US) | 1997-05-09 | — | — | WO | disclosed |