Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.56 |
| ▸ | HTR3B | O95264 | 1/20 | 0.56 |
| ▸ | HTR3A | P46098 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31142966 | 1.00 | HRH4 (0.56) | HRH4HTR3BHTR3AMAPTMAPK13 | |
| SCHEMBL24969701 | 1.00 | HRH4 (0.56) | HRH4HTR3BHTR3AMAPTMAPK13 | |
| Hydrochloric Acid SCHEMBL29268333 | 0.99 | HRH4 (0.55) | HRH4HTR3BHTR3AMAPTMAPK13 | |
| Hydrochloric Acid SCHEMBL30223438 | 0.82 | ADRA2A (0.41) | MAPTMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL4307835 | 0.79 | HTR3A (0.66) | HRH4HTR3BHTR3AMAPTTSHR | |
| SCHEMBL31143046 | 0.79 | HTR3A (0.66) | HRH4HTR3BHTR3AMAPTTSHR | |
| SCHEMBL27934102 | 0.78 | ALDH1A1 (0.42) | HRH4HTR3BHTR3AMAPTTDP1 | |
| SCHEMBL17014815 | 0.78 | GPR6 (0.52) | — | |
| Hydrochloric Acid SCHEMBL30222871 | 0.77 | HTR3A (0.64) | HRH4HTR3BHTR3AMAPTTSHR | |
| SCHEMBL3669381 | 0.77 | MEN1 (0.55) | HRH4MAPK13MAPK12MAPK11MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023002011-A1 | GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-01-26 | — | — | WO | disclosed |