Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4239928 | 0.83 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1CA1CA2ALDH1A1 | |
| SCHEMBL21363250 | 0.80 | HSP90AA1 (0.64) | HSP90AA1HSP90AB1ALDH1A1LMNASLC6A2 | |
| SCHEMBL30777025 | 0.77 | MAOA (0.50) | MAOAMAP4K4CA1CA2ALDH1A1 | |
| SCHEMBL8359609 | 0.77 | MAOA (0.50) | MAOAMAP4K4CA1CA2ALDH1A1 | |
| SCHEMBL28628075 | 0.76 | MAP4K4 (0.46) | MAOAMAP4K4CA1CA2ALDH1A1 | |
| SCHEMBL4241557 | 0.75 | APP (0.50) | HSP90AA1HSP90AB1LMNASLC6A2HTR2B | |
| SCHEMBL6575802 | 0.74 | MAOA (0.50) | MAOAMCL1CNR1CNR2MAP4K4 | |
| SCHEMBL3784572 | 0.74 | MCL1 (0.51) | MAOAMCL1CNR1CNR2MAP4K4 | |
| SCHEMBL21409737 | 0.73 | MAOA (0.41) | MAOAMAP4K4ALDH1A1LMNACYP3A4 | |
| SCHEMBL4383317 | 0.73 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1ALDH1A1CYP1A2CYP3A4 |
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 | disclosed |
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |