Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRK2 | P25098 | 1/20 | 0.49 |
| ▸ | CASP6 | P55212 | 1/20 | 0.49 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.49 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TGM2 | P21980 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CTSC | P53634 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.41 |
| ▸ | UBE2M | P61081 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18591145 | 0.84 | GRK2 (0.49) | GRK2CASP6CASP8CTDSP1TDP1 | |
| SCHEMBL29545839 | 0.84 | GRK2 (0.49) | GRK2CASP6CASP8CTDSP1TDP1 | |
| SCHEMBL25111554 | 0.83 | DPP4 (0.54) | TDP1L3MBTL1GAARAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL18554739 | 0.83 | GRK2 (0.48) | GRK2CASP6CASP8CTDSP1TDP1 | |
| SCHEMBL18155287 | 0.83 | ESR1 (0.54) | L3MBTL1GAARAB9AMEN1NPC1 | |
| SCHEMBL21092645 | 0.83 | ESR1 (0.54) | L3MBTL1GAARAB9AMEN1NPC1 | |
| SCHEMBL18710626 | 0.83 | ESR1 (0.54) | L3MBTL1GAARAB9AMEN1NPC1 | |
| SCHEMBL22251574 | 0.83 | ESR1 (0.54) | L3MBTL1GAARAB9AMEN1NPC1 | |
| SCHEMBL1752348 | 0.76 | GRK2 (0.58) | GRK2CASP6CASP8CTDSP1TDP1 | |
| SCHEMBL18611277 | 0.75 | HPGD (0.43) | CTSCHPGDSMN1; SMN2GRM5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4400497-A1 | 3CLPRO PROTEASE INHIBITOR | Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) | 2024-07-17 | — | — | EP | disclosed |