Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 2/20 | 0.35 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTGFR | P43088 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL28062144 | 0.81 | PDE4A (0.55) | HTTKMT2AMEN1MAPTLMNA | |
| SCHEMBL24792659 | 0.81 | EGFR (0.35) | HTTKMT2ACYP1A2ALDH1A1MAPT | |
| SCHEMBL30170750 | 0.81 | EGFR (0.35) | HTTKMT2ACYP1A2ALDH1A1MAPT | |
| SCHEMBL27967508 | 0.79 | HTT (0.40) | HTTKMT2AMEN1BCHEACHE | |
| SCHEMBL28608959 | 0.79 | HTT (0.40) | HTTKMT2AMEN1BCHEACHE | |
| SCHEMBL3665515 | 0.79 | BCHE (0.41) | HTTKMT2AMEN1BCHEACHE | |
| SCHEMBL23690320 | 0.77 | PDE2A (0.38) | MAPTSMN1; SMN2 | |
| SCHEMBL28608961 | 0.77 | HTT (0.38) | HTTKMT2AMEN1BCHEACHE | |
| SCHEMBL4744678 | 0.73 | CRHR1 (0.50) | HTTKMT2AMEN1BCHEACHE | |
| SCHEMBL23520672 | 0.72 | PARP1 (0.44) | HTTKMT2AMEN1CYP1A2ALDH1A1 |
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-113004210-A | Quinazoline-4-selenium salt compound, preparation method and biological activity | 鲁东大学 | 2021-06-22 | — | — | CN | disclosed |
| CN-104000828-B | Quinazoline two selenium salt compounds and preparation method and biologically active | 鲁东大学 | 2016-07-06 | — | — | CN | disclosed |