Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.41 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | CTSA | P10619 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28323667 | 0.85 | LMNA (0.49) | IRAK4HPGDMAPTBCAT2KEAP1 | |
| SCHEMBL4069438 | 0.78 | POLB (0.50) | MAPTPOLBP2RX3P2RX2MEN1 | |
| SCHEMBL527995 | 0.77 | PARP1 (0.56) | IRAK4HPGDHSD17B10BCAT2KEAP1 | |
| SCHEMBL29493488 | 0.77 | BCAT2 (0.53) | IRAK4HPGDMAPTTSHRHSD17B10 | |
| SCHEMBL13848278 | 0.76 | PARP14 (0.51) | MAPTMEN1LMNAKMT2AKDM4E | |
| SCHEMBL528360 | 0.75 | HTT (0.48) | HPGDMAPTBCAT2PARP1MEN1 | |
| SCHEMBL29706670 | 0.74 | LMNA (0.52) | HPGDMAPTBCAT2PARP1MEN1 | |
| SCHEMBL26551435 | 0.73 | POLB (0.56) | HPGDMAPTPOLBTSHRHSD17B10 | |
| Acetic Acid SCHEMBL8910187 | 0.73 | BCAT2 (0.53) | IRAK4HPGDMAPTTSHRHSD17B10 | |
| SCHEMBL27316536 | 0.72 | P2RX3 (0.53) | HPGDMAPTPOLBTSHRHSD17B10 |
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-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |