Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 3/20 | 0.67 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.67 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.58 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.56 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4061329 | 0.87 | BCL2 (0.50) | BCL2MCL1GABRA1GABRB1HSP90AA1 | |
| SCHEMBL4057923 | 0.86 | BCL2 (0.50) | BCL2MCL1GABRA1GABRB1HSP90AA1 | |
| SCHEMBL4070902 | 0.84 | LMNA (0.53) | BCL2MCL1HSP90AA1HSP90AB1LMNA | |
| SCHEMBL28000168 | 0.84 | HSP90AA1 (0.54) | BCL2MCL1HSP90AA1HSP90AB1LMNA | |
| SCHEMBL295850 | 0.82 | KMT2A (0.68) | BCL2MCL1LMNAMAPTHPGD | |
| SCHEMBL4069791 | 0.81 | HPGD (0.60) | BCL2MCL1HSP90AA1HSP90AB1LMNA | |
| SCHEMBL4247963 | 0.81 | LMNA (0.52) | BCL2MCL1HSP90AA1LMNAMAPT | |
| SCHEMBL11695892 | 0.81 | BCL2 (0.68) | BCL2MCL1GABRA1GABRB1LMNA | |
| SCHEMBL30063117 | 0.80 | LMNA (0.66) | BCL2MCL1LMNAMAPTHPGD | |
| SCHEMBL170272 | 0.80 | LMNA (0.66) | BCL2MCL1LMNAMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | claimed |
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |