Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.37 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1148629 | 0.81 | ALOX5 (0.44) | KCNMA1ALDH1A1HPGDBCL2L1HSD17B10 | |
| SCHEMBL4088457 | 0.79 | KCNMA1 (0.36) | KCNMA1BRD4MAPTKDM4EPOLB | |
| SCHEMBL4077177 | 0.78 | KDM4E (0.39) | KCNMA1ALDH1A1HPGDHSD17B10L3MBTL1 | |
| SCHEMBL3974239 | 0.77 | KCNMA1 (0.36) | KCNMA1CCNE1CDK2RAB9AMEN1 | |
| SCHEMBL3974759 | 0.77 | MAPK9 (0.41) | KCNMA1CCNE1CDK2MAPK10 | |
| SCHEMBL3973703 | 0.76 | KCNN4 (0.37) | KCNMA1ALDH1A1HPGDHSD17B10L3MBTL1 | |
| SCHEMBL4089989 | 0.76 | MGAM (0.35) | KCNMA1KCNN4GAA | |
| SCHEMBL5329381 | 0.76 | TRPA1 (0.40) | KCNMA1ALDH1A1GAA | |
| SCHEMBL3974423 | 0.75 | KDM4E (0.36) | KCNMA1ALDH1A1CDK2KDM4EKMT2A | |
| SCHEMBL1148311 | 0.75 | KCNMA1 (0.46) | KCNMA1ALDH1A1HPGDHSD17B10DHODH |
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-2054059-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2009-05-06 | — | — | EP | claimed |
| WO-2008021364-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-02-21 | — | — | WO | claimed |