Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 6/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3348657 | 0.86 | CA1 (0.40) | BRD4LMNACA1CA2CA12 | |
| SCHEMBL16884156 | 0.70 | PTPN11 (0.41) | BRD4LMNACA1CA2HTT | |
| SCHEMBL8443828 | 0.68 | MEN1 (0.40) | CA1CA2CA12CA9SCN2A | |
| SCHEMBL13505081 | 0.68 | KMT2A (0.47) | BRD4HTTRXFP1KMT2A | |
| SCHEMBL13505057 | 0.67 | KMT2A (0.39) | CA1CA2CA12CA9SCN2A | |
| SCHEMBL8298982 | 0.67 | BRD4 (0.41) | BRD4HTR6DRD2HTR2AHTR1A | |
| SCHEMBL14049066 | 0.67 | BRD4 (0.39) | BRD4CA1CA2CA12CA9 | |
| SCHEMBL13620691 | 0.66 | HTR6 (0.53) | BRD4CA1CA2CA12CA9 | |
| SCHEMBL8192188 | 0.65 | PDPK1 (0.47) | BRD4CA1CA2CA12CA9 | |
| SCHEMBL12657360 | 0.65 | L3MBTL1 (0.58) | HTR6HTTCYP2C19KMT2A |
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-1749829-B1 | JNK inhibitors | EISAI R&D MAN CO LTD (JP) | 2010-11-03 | — | — | EP | disclosed |
| EP-1749829-A1 | JNK inhibitors | Eisai London Research Laboratories Limited (GB) | 2007-02-07 | — | — | EP | disclosed |