Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 20/20 | 0.65 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.65 |
| ▸ | NR2C2 | P49116 | 3/20 | 0.65 |
| ▸ | HIPK4 | Q8NE63 | 2/20 | 0.65 |
| ▸ | BMP2K | Q9NSY1 | 2/20 | 0.65 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.65 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.65 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.53 |
| ▸ | GAK | O14976 | 1/20 | 0.53 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.53 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CLK1 | P49759 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28480248 | 0.88 | AAK1 (0.67) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL20447258 | 0.84 | AAK1 (0.61) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL20496190 | 0.83 | AAK1 (0.68) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL28480653 | 0.81 | AAK1 (0.56) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL19901189 | 0.79 | AAK1 (1.00) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL30059576 | 0.79 | AAK1 (1.00) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL29399649 | 0.79 | AAK1 (1.00) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL17155337 | 0.79 | AAK1 (1.00) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL17143808 | 0.78 | AAK1 (0.84) | AAK1ROCK2NR2C2HIPK4BMP2K | |
| SCHEMBL28487403 | 0.77 | AAK1 (0.71) | AAK1ROCK2NR2C2HIPK4BMP2K |
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-112142655-A | Biaryl kinase inhibitors | 百时美施贵宝公司 | 2020-12-29 | — | — | CN | disclosed |
| CN-108368084-B | Biaryl kinase inhibitors | 百时美施贵宝公司 | 2020-10-16 | — | — | CN | disclosed |