Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892515 | 1.00 | POLB (0.52) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL28892731 | 0.88 | POLB (0.41) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL28892702 | 0.87 | POLB (0.40) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL30002411 | 0.82 | DRD2 (0.39) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL28892396 | 0.82 | DRD2 (0.39) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL28892454 | 0.82 | POLB (0.50) | POLBHTR1ASLC6A4NR3C1PGR | |
| SCHEMBL30002775 | 0.74 | POLB (0.80) | POLBTSHRLMNAMAPTKMT2A | |
| SCHEMBL7536952 | 0.74 | HTR1A (0.44) | HTR1ASLC6A4NR3C1PGRNR3C2 | |
| SCHEMBL31140543 | 0.72 | TP53 (0.47) | POLBHTR1AKCNH2TSHRGRM5 | |
| SCHEMBL16896933 | 0.71 | HTR2A (0.38) | POLBHTR1ASLC6A4NR3C1PGR |
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-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |