Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23715875 | 0.85 | IDO1 (0.37) | IDO1L3MBTL1NPC1RAB9AALDH1A1 | |
| SCHEMBL23716075 | 0.83 | IDO1 (0.40) | IDO1SLC6A2SLC6A3SLC6A4LMNA | |
| SCHEMBL23716188 | 0.79 | ANO1 (0.33) | — | |
| SCHEMBL23715899 | 0.75 | IDO1 (0.37) | IDO1L3MBTL1NPC1RAB9AHTR3E | |
| SCHEMBL23716096 | 0.75 | IDO1 (0.37) | IDO1L3MBTL1NPC1RAB9AHTR3E | |
| SCHEMBL23715915 | 0.72 | IDO1 (0.35) | IDO1L3MBTL1NPC1RAB9AHTR3E | |
| SCHEMBL23715894 | 0.72 | CYP2C9 (0.38) | IDO1L3MBTL1NPC1RAB9AHTR3E | |
| SCHEMBL27760048 | 0.72 | IDO1 (0.47) | IDO1L3MBTL1NPC1RAB9AHTR3E | |
| SCHEMBL23716093 | 0.68 | IDO1 (0.41) | IDO1L3MBTL1NPC1RAB9ACTBP2 | |
| SCHEMBL23716003 | 0.68 | CTBP2 (0.38) | IDO1L3MBTL1NPC1RAB9AHTR3E |
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-3209732-B1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | SCRIPPS RESEARCH INST (US) | 2021-08-04 | — | — | EP | disclosed |