Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27387168 | 0.86 | GPR84 (0.44) | GPR84PARP1KDM4EATMSMN1; SMN2 | |
| SCHEMBL16730912 | 0.79 | GPR84 (0.56) | GPR84PARP1ATMNR3C1NR3C2 | |
| SCHEMBL12606661 | 0.79 | PBRM1 (0.46) | KDM4EHSD17B10CTNNB1WNT3ACFTR | |
| SCHEMBL17464422 | 0.77 | CTNNB1 (0.37) | GPR84PARP1KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL1353154 | 0.77 | CYP1A2 (0.51) | KDM4ESMN1; SMN2HSD17B10CTNNB1WNT3A | |
| SCHEMBL29464955 | 0.76 | ALDH1A1 (0.46) | PARP1KDM4EATMHSD17B10CTNNB1 | |
| SCHEMBL12606659 | 0.76 | CTNNB1 (0.42) | PARP1KDM4ESMN1; SMN2HSD17B10CTNNB1 | |
| SCHEMBL1350659 | 0.76 | KDM4E (0.67) | KDM4EHSD17B10CTNNB1WNT3AJAK2 | |
| SCHEMBL16229083 | 0.75 | KDM4E (0.51) | KDM4EHSD17B10CTNNB1WNT3AJAK2 | |
| SCHEMBL2030771 | 0.75 | GPR84 (0.43) | GPR84PARP1ATMJAK2CFTR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102227424-B | Modulators of cystic fibrosis transmembrane conductance regulator | VERTEX PHARMA | 2013-08-14 | — | — | CN | disclosed |
| CN-102227424-A | Modulators of cystic fibrosis transmembrane conductance regulator | VERTEX PHARMA | 2011-10-26 | — | — | CN | disclosed |