Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 9/20 | 0.48 |
| ▸ | IRAK4 | Q9NWZ3 | 5/20 | 0.38 |
| ▸ | MAP2K3 | P46734 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | CCNC | P24863 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1384983 | 0.72 | IKBKB (0.67) | IKBKBKDM4EHSD17B10PPARGNCOA2 | |
| SCHEMBL22609532 | 0.69 | IKBKB (0.49) | IKBKBMAP2K3KDM4EHSD17B10PPARG | |
| SCHEMBL4088592 | 0.65 | IKBKB (1.00) | IKBKB | |
| SCHEMBL626644 | 0.65 | IKBKB (0.54) | IKBKBMAP2K3KDM4EHSD17B10PPARG | |
| SCHEMBL31198739 | 0.63 | IKBKB (0.63) | IKBKBKDM4EHSD17B10PPARGNCOA2 | |
| SCHEMBL15639467 | 0.63 | SIRT3 (0.46) | IRAK4KDM4EALDH1A1 | |
| SCHEMBL30106359 | 0.63 | GSK3B (0.51) | IKBKBPPARG | |
| SCHEMBL3123539 | 0.62 | NPC1 (0.50) | IKBKBMAP2K3NPC1RAB9AJAK2 | |
| SCHEMBL3124862 | 0.62 | IKBKB (0.71) | IKBKBMAP2K3KDM4EHSD17B10PPARG | |
| SCHEMBL3114611 | 0.61 | IKBKB (0.62) | IKBKBKDM4EPPARGNPC1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4054573-A1 | TOPICAL COMPOSITIONS COMPRISING IRAK4 INHIBITORS FOR USE IN TREATING DERMATOLOGICAL CONDITIONS CHARACTERISED BY INFLAMMATION | Dermira, Inc (US) | 2022-09-14 | — | — | EP | claimed |
| EP-4054573-A1 | TOPICAL COMPOSITIONS COMPRISING IRAK4 INHIBITORS FOR USE IN TREATING DERMATOLOGICAL CONDITIONS CHARACTERISED BY INFLAMMATION | Dermira, Inc (US) | 2022-09-14 | — | — | EP | disclosed |