Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 2/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18387217 | 0.90 | TSHR (0.46) | PDE2ANR1H4GRIA4TSHRATM | |
| SCHEMBL19772091 | 0.81 | PDE2A (0.48) | PDE2ATSHRALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL16230724 | 0.81 | PDE2A (0.48) | PDE2ATSHRALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL19772099 | 0.81 | PDE2A (0.48) | PDE2ATSHRALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL24777081 | 0.78 | PDE2A (0.33) | PDE2ANR1H4ALDH1A1ALOX15 | |
| SCHEMBL30949389 | 0.77 | CHRNA7 (0.42) | TSHRLMNAALDH1A1TDP1 | |
| SCHEMBL15961450 | 0.75 | CYP2A6 (0.40) | LMNACYP2D6CYP2C9ALDH1A1HSD17B10 | |
| SCHEMBL10152860 | 0.75 | ADRB2 (0.52) | TSHRLMNAHIF1ATP53HPGD | |
| SCHEMBL20224127 | 0.75 | AOC3 (0.39) | LMNAALDH1A1HDAC1HDAC8HDAC6 | |
| SCHEMBL14411802 | 0.75 | ESR1 (0.56) | TSHRLMNACYP2D6CYP2C9HIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118165230-A | Covalent organic framework material with three-dimensional cage-type framework structure and preparation method thereof | 河南科技大学 | 2024-06-11 | — | — | CN | claimed |
| CN-118165230-A | Covalent organic framework material with three-dimensional cage-type framework structure and preparation method thereof | 河南科技大学 | 2024-06-11 | — | — | CN | disclosed |
| CN-113751076-A | Double-imidazolium-salt palladium-supported porous organic polymer catalyst and preparation method and application thereof | 南京工业大学 | 2021-12-07 | — | — | CN | disclosed |