Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ACP3 | P15309 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 2/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PGK2 | P07205 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 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 | |
|---|---|---|---|---|
| SCHEMBL29994747 | 1.00 | CYP4F2 (0.38) | CYP4F2CYP4A11MIFGRIN2BCYP1A2 | |
| SCHEMBL27672290 | 0.87 | MIF (0.38) | MIFGRIN2BCYP1A2CYP2C19HDAC2 | |
| SCHEMBL16363565 | 0.80 | MIF (0.57) | MIFGRIN2BACP3GRIN1ALDH1A1 | |
| SCHEMBL13887515 | 0.78 | GRIN2D (0.43) | MIFGRIN2BCYP1A2CYP2C19HDAC3 | |
| SCHEMBL14872978 | 0.78 | PDE2A (0.39) | GRIN2BCYP1A2HDAC3HDAC1HDAC2 | |
| SCHEMBL17479948 | 0.77 | HDAC1 (0.39) | CYP4F2CYP4A11HDAC3HDAC1HDAC2 | |
| SCHEMBL14870335 | 0.77 | GRIN2D (0.34) | GRIN2BHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL18802729 | 0.75 | TAAR1 (0.46) | CYP4F2CYP4A11MIFCYP1A2CYP2C19 | |
| SCHEMBL548707 | 0.75 | CYP1A2 (0.42) | CYP4F2CYP4A11CYP1A2CYP2C19ACP3 | |
| SCHEMBL129592 | 0.75 | KIF11 (0.46) | CYP4F2CYP4A11CYP1A2CYP2C19ACP3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116981669-A | Pyrimidine or pyrido heterocyclic adenosine receptor inhibitor, preparation method and application thereof | 上海齐鲁制药研究中心有限公司 | 2023-10-31 | — | — | CN | disclosed |