Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 2/20 | 0.77 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HNF4A | P41235 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.46 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.46 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 2/20 | 0.45 |
| ▸ | IKBKB | O14920 | 2/20 | 0.44 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.44 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2935188 | 0.96 | BCAT2 (0.84) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL16149659 | 0.91 | BCAT2 (0.91) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL1110181 | 0.89 | BCAT2 (0.71) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL31012518 | 0.89 | BCAT2 (0.71) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL132986 | 0.87 | BCAT2 (1.00) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL29427545 | 0.87 | BCAT2 (1.00) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL30514077 | 0.87 | BCAT2 (0.74) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL210767 | 0.87 | BCAT2 (0.74) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| Urea SCHEMBL28572437 | 0.85 | BCAT2 (0.96) | BCAT2KEAP1NFE2L2NPC1RAB9A | |
| SCHEMBL28355265 | 0.85 | BCAT2 (0.96) | BCAT2KEAP1NFE2L2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102333779-A | Benzopyran and benzoxex PI3K inhibitor compounds and methods of use | GENENTECH INC | 2012-01-25 | — | — | CN | claimed |
| CN-102333779-B | Benzopyran and benzoxex PI3K inhibitor compounds and methods of use | GENENTECH, INC. (US) | 2015-12-09 | — | — | CN | disclosed |
| CN-102333779-A | Benzopyran and benzoxex PI3K inhibitor compounds and methods of use | GENENTECH INC | 2012-01-25 | — | — | CN | disclosed |