Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 3/20 | 0.47 |
| ▸ | PYGL | P06737 | 2/20 | 0.44 |
| ▸ | KDM5B | Q9UGL1 | 3/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.44 |
| ▸ | KDM4A | O75164 | 1/20 | 0.44 |
| ▸ | KDM5A | P29375 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | PRNP | P04156 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL28129461 | 0.87 | KDM5B (0.48) | F2KDM5BKDM4CKDM4AKDM5A | |
| SCHEMBL28178529 | 0.83 | F2 (0.58) | F2PYGLIDO1CYP19A1 | |
| SCHEMBL977626 | 0.74 | F2 (0.70) | F2KDM5BKDM4CKDM4AKDM5A | |
| SCHEMBL7469855 | 0.74 | GABRA1 (0.46) | NPC1RAB9A | |
| SCHEMBL6995529 | 0.72 | EGFR (0.44) | F2IDO1CYP19A1HCAR2 | |
| SCHEMBL7648523 | 0.72 | KDM5B (0.60) | F2KDM5BKDM4CKDM4AKDM5A | |
| SCHEMBL865591 | 0.72 | CYP19A1 (0.50) | F2FFAR1IDO1CYP19A1 | |
| SCHEMBL28806343 | 0.70 | F2 (0.64) | F2FFAR1IDO1NPC1RAB9A | |
| SCHEMBL7419729 | 0.70 | LOXL2 (0.57) | F2FFAR1IDO1NPC1RAB9A | |
| SCHEMBL6989926 | 0.70 | LOXL2 (0.49) | F2FFAR1IDO1CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104804004-B | A kind of preparation method of chiral hexahydropyrrolo diindyl class compound | 安徽师范大学 | 2017-03-29 | — | — | CN | disclosed |