Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | DDO | Q99489 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2078975 | 0.77 | DHODH (0.58) | KDM4EALDH1A1DHODHDAOHPGD | |
| SCHEMBL29696398 | 0.75 | PDPK1 (0.53) | KDM4EALDH1A1DHODHHSD17B10GAA | |
| SCHEMBL19857562 | 0.75 | PDPK1 (0.53) | KDM4EALDH1A1DHODHHSD17B10GAA | |
| SCHEMBL15658687 | 0.73 | NR4A1 (0.53) | KDM4EALDH1A1HPGDHSD17B10NPSR1 | |
| SCHEMBL7014604 | 0.73 | KDM4E (0.48) | KDM4EALDH1A1DHODHHPGDHSD17B10 | |
| SCHEMBL10446352 | 0.70 | SLC6A2 (0.49) | HPGDHTTSMN1; SMN2MAPK1TSHR | |
| SCHEMBL5673146 | 0.70 | DAO (0.60) | KDM4EALDH1A1DAOHPGDHSD17B10 | |
| SCHEMBL7422427 | 0.69 | ALDH1A1 (0.52) | KDM4EALDH1A1NPSR1GAASMN1; SMN2 | |
| SCHEMBL21207887 | 0.68 | ESR1 (0.44) | KDM4EALDH1A1GAASMN1; SMN2MAPT | |
| SCHEMBL19380603 | 0.68 | GABRA1 (0.39) | HPGDSMN1; SMN2MAPTLMNAMAPK1 |
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-2017037116-A1 | PYRIDINONE DICARBOXAMIDE FOR USE AS BROMODOMAIN INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2017-03-09 | — | — | WO | disclosed |