Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20619766 | 0.95 | S1PR1 (0.39) | S1PR1S1PR3PDE3BPDE3ACYP11B2 | |
| SCHEMBL23912071 | 0.95 | S1PR1 (0.39) | S1PR1S1PR3PDE3BPDE3ACYP11B2 | |
| SCHEMBL20619767 | 0.91 | S1PR1 (0.39) | S1PR1S1PR3PDE3BPDE3ACYP11B2 | |
| SCHEMBL20619469 | 0.91 | HTR6 (0.41) | S1PR1S1PR3CYP11B2CYP11B1HTR2B | |
| SCHEMBL19919683 | 0.90 | S1PR1 (0.38) | S1PR1S1PR3CYP11B2CYP11B1AR | |
| SCHEMBL20619765 | 0.90 | S1PR1 (0.39) | S1PR1S1PR3PDE3BPDE3ACYP11B2 | |
| SCHEMBL21258680 | 0.89 | AR (0.42) | ARALOX5APFEN1 | |
| SCHEMBL23912038 | 0.88 | HTR6 (0.43) | S1PR1CYP11B2CYP11B1HTR2BHTR6 | |
| SCHEMBL19917978 | 0.87 | AR (0.39) | ARALOX5APFEN1 | |
| SCHEMBL20619480 | 0.87 | CYP11B2 (0.41) | CYP11B2CYP11B1HTR2BHTR6AR |
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-3645522-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2021-10-13 | — | — | EP | disclosed |