Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.37 |
| ▸ | CDK4 | P11802 | 2/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
| ▸ | PRKACG | P22612 | 2/20 | 0.37 |
| ▸ | PRKACB | P22694 | 2/20 | 0.37 |
| ▸ | CCND1 | P24385 | 2/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.37 |
| ▸ | CDK2 | P24941 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17861173 | 0.77 | ATM (0.45) | SIRT2SIRT1GPR84CYP2A6IMPDH2 | |
| SCHEMBL8520286 | 0.76 | HSP90AA1 (0.54) | SIRT2SIRT1MEN1MAPTKMT2A | |
| SCHEMBL7372110 | 0.73 | PRKD3 (0.44) | CDK4PRKACAPRKACGPRKACBCCND1 | |
| SCHEMBL29009659 | 0.72 | CA12 (0.47) | CA12BRD4BRPF1CA9KAT2B | |
| SCHEMBL27993072 | 0.72 | PRKD3 (0.42) | CDK4PRKACAPRKACGPRKACBCCND1 | |
| SCHEMBL4020602 | 0.71 | NR4A2 (0.50) | SIRT2PRKCAGPR84MEN1MAPT | |
| SCHEMBL17505155 | 0.69 | CA12 (0.47) | CA12BRD4BRPF1CA9KAT2B | |
| SCHEMBL9270290 | 0.69 | POLB (0.50) | CA12BRD4BRPF1CA9KAT2B | |
| SCHEMBL19444481 | 0.69 | SIRT2 (0.40) | SIRT2SIRT1CCNE2CDK4PRKACA | |
| SCHEMBL500223 | 0.69 | CA12 (0.43) | CA12BRD4BRPF1CA9KAT2B |
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-2018042096-A1 | 2-QUINOLIN-2-ONE DERIVATIVES AS MODULATORS OF NMDA RECEPTORS, COMPOSITIONS COMPRISING SAME AND USE OF THESE COMPOUNDS IN THE TREATMENT OF DISEASES INVOLVING THE CENTRAL NERVOUS SYSTEM | ADPUERIVITAM (FR) | 2018-03-08 | — | — | WO | disclosed |