Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907923 | 0.89 | PTGDR2 (0.53) | PTGDR2AKR1C3AKR1C2CNR2PTGS2 | |
| SCHEMBL17907926 | 0.88 | PTGDR2 (0.47) | PTGDR2AKR1C3AKR1C2PTGDRTBXA2R | |
| SCHEMBL17907960 | 0.88 | PTGDR2 (0.49) | PTGDR2AKR1C3CNR2PTGS2PTGDR | |
| SCHEMBL17907993 | 0.88 | PTGDR2 (0.50) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL17907989 | 0.85 | PTGDR2 (0.52) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL13278753 | 0.81 | PTGDR2 (0.59) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL13278751 | 0.81 | PTGDR2 (0.59) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL13278879 | 0.81 | PTGDR2 (0.59) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL17907967 | 0.81 | PTGDR2 (0.59) | PTGDR2PTGDRTBXA2R | |
| SCHEMBL17907972 | 0.79 | PTGDR2 (0.52) | PTGDR2PTGDRTBXA2R |
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-2697223-B1 | 7-(HETEROARYL-AMINO)-6,7,8,9-TETRAHYDROPYRIDO[1,2-A]INDOL ACETIC ACID DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2016-07-13 | — | — | EP | disclosed |