Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.56 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.56 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.56 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | KHK | P50053 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | XIAP | P98170 | 2/20 | 0.39 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 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 | |
|---|---|---|---|---|
| SCHEMBL5632344 | 1.00 | ADRB1 (0.56) | ADRB1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL5632352 | 1.00 | ADRB1 (0.56) | ADRB1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL30208090 | 0.83 | HTR3E (0.61) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL2245201 | 0.83 | HTR3E (0.61) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL12892626 | 0.83 | HTR3E (0.61) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL4240000 | 0.83 | HTR3E (0.61) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| Hydrochloric Acid SCHEMBL20139242 | 0.82 | HTR3E (0.59) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL1203360 | 0.82 | HTR3E (0.56) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL2874784 | 0.82 | HTR3E (0.56) | ADRB1BCL2A1ALDH1A1LMNANOTUM | |
| SCHEMBL1203357 | 0.82 | HTR3E (0.56) | ADRB1BCL2A1ALDH1A1LMNANOTUM |
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-2022220725-A1 | LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS | ZAMARATSKI EDOUARD (SE) | 2022-10-20 | — | — | WO | disclosed |