Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2651126 | 0.86 | ALOX5AP (0.44) | CYP11B1CYP11B2ALDH1A1KDM4EUSP2 | |
| SCHEMBL5901013 | 0.82 | ALDH1A1 (0.48) | ALDH1A1KDM4EUSP2HPGDMAPT | |
| SCHEMBL2648034 | 0.81 | GABRA1 (0.42) | CYP11B1CYP11B2ALDH1A1KDM4EUSP2 | |
| SCHEMBL7572084 | 0.79 | PLA2G7 (0.49) | ALDH1A1KDM4EUSP2HPGDMAPT | |
| SCHEMBL25260661 | 0.79 | BRD4 (0.51) | ALDH1A1KDM4EHPGDMAPTSMN1; SMN2 | |
| SCHEMBL2650416 | 0.79 | ESR2 (0.48) | CYP11B1CYP11B2ALDH1A1KDM4ECHUK | |
| SCHEMBL9069185 | 0.77 | ESR2 (0.47) | CYP11B1CYP11B2ALDH1A1KDM4ECHUK | |
| SCHEMBL2651159 | 0.77 | GABRA1 (0.44) | CYP11B1CYP11B2ALDH1A1KDM4EUSP2 | |
| SCHEMBL7575965 | 0.77 | MCL1 (0.47) | CYP11B1CYP11B2ALDH1A1KDM4EUSP2 | |
| SCHEMBL2958151 | 0.77 | KDM4E (0.49) | ALDH1A1KDM4EUSP2HPGDMAPT |
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-2003006464-A1 | (1,8) NAPHTHYRIDINES AS GABA LIGANDS, THEIR PHARMACEUTICAL COMPOSITIONS AND USES | MERCK SHARP & DOHME LIMITED (GB) | 2003-01-23 | — | — | WO | disclosed |