Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 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 | |
|---|---|---|---|---|
| SCHEMBL13984116 | 0.79 | DHFR (0.66) | DHFRSMN1; SMN2HRH2HRH1CYP2C19 | |
| SCHEMBL22544180 | 0.79 | NPC1 (0.48) | DHFRNR1H2GABRPGABRDGABRA1 | |
| SCHEMBL3653540 | 0.79 | NR1H2 (0.56) | LMNAPOLBSMN1; SMN2NR1H2PTGDR2 | |
| SCHEMBL8440118 | 0.79 | NR1H2 (0.62) | LMNAPOLBSMN1; SMN2NR1H2PTGDR2 | |
| SCHEMBL30405378 | 0.78 | HSP90AA1 (0.48) | LMNAPOLBSMN1; SMN2SMYD3HSP90AA1 | |
| SCHEMBL10255757 | 0.78 | NR1H2 (0.62) | NR1H2MAPT | |
| SCHEMBL29508891 | 0.78 | NR1H2 (0.62) | NR1H2MAPT | |
| SCHEMBL30405301 | 0.77 | HSP90AA1 (0.49) | LMNAPOLBSMN1; SMN2SMYD3HSP90AA1 | |
| SCHEMBL13601656 | 0.77 | SMYD3 (0.43) | DHFRLMNAPOLBSMN1; SMN2SMYD3 | |
| SCHEMBL21182045 | 0.77 | SLC6A15 (0.45) | LMNASMN1; SMN2HRH2HRH1OPRD1 |
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-108264512-A | Nitrogenous fused heterocyclic compound, preparation method, intermediate, composition and application | 上海医药集团股份有限公司 | 2018-07-10 | — | — | CN | disclosed |
| CN-106928219-A | Nitrogenous fused heterocyclic compound, preparation method, intermediate, composition and application | 上海医药集团股份有限公司 | 2017-07-07 | — | — | CN | disclosed |