Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.41 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.41 |
| ▸ | RPS6KB2 | Q9UBS0 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | VDR | P11473 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23595086 | 0.90 | KDM4E (0.46) | PPARGNPC1RAB9APDE3BPDE3A | |
| SCHEMBL23582418 | 0.83 | PIK3CG (0.47) | LCKPPARGPIK3CGPPARD | |
| SCHEMBL28603278 | 0.77 | PIK3CG (0.46) | LCKPIK3CGNPC1RAB9AMAPT | |
| SCHEMBL23582306 | 0.76 | ALDH1A1 (0.59) | NPC1RAB9AMAPTLMNAKDM4E | |
| SCHEMBL27987894 | 0.76 | PLAU (0.52) | PPARGNPC1RAB9APDE3BPDE3A | |
| SCHEMBL73636 | 0.74 | RAB9A (0.57) | NPC1RAB9AMAPTLMNA | |
| SCHEMBL9380420 | 0.74 | PIK3CG (0.56) | LCKPIK3CGNPC1RAB9AMAPT | |
| SCHEMBL253529 | 0.74 | PIK3CG (0.56) | LCKPIK3CGNPC1RAB9AMAPT | |
| SCHEMBL21617914 | 0.73 | LMNA (0.60) | NPC1RAB9AMAPTLMNAKDM4E | |
| SCHEMBL9376288 | 0.72 | LCK (0.42) | LCKPIK3CGNPC1RAB9AMAPT |
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-2021133035-A1 | NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF | 주식회사 엘지화학 | 2021-07-01 | — | — | WO | disclosed |