Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TOP1 | P11387 | 2/20 | 0.46 |
| ▸ | TOP2A | P11388 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4553001 | 1.00 | HTR3A (0.54) | HTR3AEGFRSMN1; SMN2KDM4ENPC1 | |
| SCHEMBL6579030 | 0.85 | MAPK1 (0.50) | ALDH1A1HSD17B10HTR1ASLC6A4SLC6A2 | |
| SCHEMBL10656773 | 0.84 | HTR1A (0.46) | EGFRHTR1ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL4553923 | 0.82 | MAPK1 (0.59) | SMN1; SMN2KDM4EALDH1A1KIF11HSD17B10 | |
| SCHEMBL30480900 | 0.82 | MAPK1 (0.59) | SMN1; SMN2KDM4EALDH1A1KIF11HSD17B10 | |
| SCHEMBL27771950 | 0.82 | HTR3E (0.56) | HTR3AKDM4EALDH1A1HTR1ASLC6A4 | |
| SCHEMBL23010838 | 0.81 | HTR3A (0.54) | HTR3ASMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL31590550 | 0.80 | ALDH1A1 (0.46) | SMN1; SMN2ALDH1A1HTR1ASLC6A4SLC6A2 | |
| SCHEMBL1081464 | 0.78 | OPRL1 (0.46) | SMN1; SMN2KDM4EALDH1A1HTR1AMAPT | |
| SCHEMBL30492866 | 0.78 | HRH4 (0.53) | HTR3ASMN1; SMN2KDM4ENPC1RAB9A |
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-2023060255-A1 | QUINOLONE ALKYL AMINES AS NOVEL SEROTONIN 2A RECEPTOR (5HT2AR) AGONISTS | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2023-04-13 | — | — | WO | disclosed |