Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.43 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.43 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.43 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.37 |
| ▸ | PHF8 | Q9UPP1 | 3/20 | 0.36 |
| ▸ | KDM2A | Q9Y2K7 | 3/20 | 0.36 |
| ▸ | KDM5C | P41229 | 2/20 | 0.36 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SLC13A3 | Q8WWT9 | 1/20 | 0.35 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL19407225 | 0.80 | TSHR (0.61) | KDM4ETSHRLMNAEGLN1ALKBH5 | |
| SCHEMBL860029 | 0.80 | TSHR (0.61) | KDM4ETSHRLMNAEGLN1ALKBH5 | |
| SCHEMBL860028 | 0.80 | TSHR (0.61) | KDM4ETSHRLMNAEGLN1ALKBH5 | |
| SCHEMBL28313147 | 0.79 | HDAC3 (0.40) | KDM4ETSHRCYP1A2HDAC3KMT2A | |
| SCHEMBL377345 | 0.79 | HDAC3 (0.40) | KDM4ETSHRCYP1A2HDAC3KMT2A | |
| SCHEMBL5176301 | 0.76 | CES1 (0.41) | TSHROR51E2CYP1A2SLC22A6KMT2A | |
| SCHEMBL5176308 | 0.76 | CES1 (0.41) | TSHROR51E2CYP1A2SLC22A6KMT2A | |
| SCHEMBL5177367 | 0.76 | CES1 (0.41) | TSHROR51E2CYP1A2SLC22A6KMT2A | |
| SCHEMBL11756273 | 0.75 | KDM4E (0.42) | KDM4ETSHR | |
| SCHEMBL11756292 | 0.75 | KDM4E (0.42) | KDM4ETSHR |
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-116327979-B | Transition metal-based mesoporous nano catalytic medicine, preparation method and application | 西南石油大学 | 2023-08-01 | — | — | CN | disclosed |