Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | CDC25B | P30305 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL22721086 | 1.00 | HPRT1 (0.41) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL29080195 | 0.83 | POLB (0.42) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL30366616 | 0.79 | HPRT1 (0.45) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL1249585 | 0.79 | HPRT1 (0.45) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL11551761 | 0.79 | CYP1A2 (0.45) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL8620345 | 0.76 | ALDH1A1 (0.50) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL29195181 | 0.75 | POLB (0.39) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL28795602 | 0.75 | POLB (0.48) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL22411435 | 0.75 | POLB (0.39) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL31610284 | 0.74 | HPRT1 (0.41) | HPRT1ALDH1A1HSD17B10HIF1ACYP1B1 |
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-112010859-B | Fused ring compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2022-07-19 | — | — | CN | disclosed |