Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 3/20 | 0.45 |
| ▸ | GBA1 | P04062 | 6/20 | 0.44 |
| ▸ | VCP | P55072 | 4/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30085464 | 1.00 | PIM1 (0.45) | PIM1GBA1VCPDYRK1ACLK4 | |
| SCHEMBL28895197 | 1.00 | PIM1 (0.45) | PIM1GBA1VCPDYRK1ACLK4 | |
| SCHEMBL28895048 | 0.89 | CDC7 (0.48) | PIM1GBA1DYRK1ACLK4PPARG | |
| SCHEMBL30085793 | 0.89 | CDC7 (0.48) | PIM1GBA1DYRK1ACLK4PPARG | |
| SCHEMBL28895160 | 0.89 | CDC7 (0.48) | PIM1GBA1DYRK1ACLK4PPARG | |
| SCHEMBL28895052 | 0.89 | CDC7 (0.48) | PIM1GBA1DYRK1ACLK4PPARG | |
| SCHEMBL30085671 | 0.89 | CDC7 (0.48) | PIM1GBA1DYRK1ACLK4PPARG | |
| SCHEMBL28894894 | 0.87 | GBA1 (0.51) | GBA1DYRK1ACLK4PPARGKMT2A | |
| SCHEMBL30085846 | 0.87 | GBA1 (0.51) | GBA1DYRK1ACLK4PPARGKMT2A | |
| SCHEMBL28894682 | 0.86 | IKBKB (0.51) | PIM1GBA1DYRK1ACLK4PPARG |
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-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | claimed |
| CN-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | disclosed |