Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 17/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 7/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3767411 | 0.81 | PTGDR2 (0.67) | PTGDR2AKR1B1CYP2C9S100A4 | |
| SCHEMBL5029623 | 0.75 | PTGDR2 (0.48) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL5029669 | 0.71 | PTGDR2 (0.45) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL6511408 | 0.68 | PTGDR2 (0.43) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL13206681 | 0.66 | PTGDR2 (0.86) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL1083439 | 0.65 | S100A4 (0.44) | PTGDR2AKR1B1S100A4 | |
| SCHEMBL27970100 | 0.65 | PTGDR2 (0.72) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL904388 | 0.65 | PTGDR2 (0.79) | PTGDR2AKR1B1CYP2C9 | |
| Azd1981 SCHEMBL1053662 | 0.63 | PTGDR2 (1.00) | PTGDR2AKR1B1CYP2C9 | |
| SCHEMBL15015952 | 0.63 | LIPE (0.36) | PTGDR2AKR1B1CYP2C9 |
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-2011004182-A1 | INTERMEDIATES AND PROCESSES FOR THE PREPARATION OF 4- (ACETYLAMINO) ) -3- [ (4-CHLORO-PHENYL) THIO] -2-METHYL-1H-INDOLE-1-ACETIC ACID | ASTRAZENECA AB (SE) | 2011-01-13 | — | — | WO | disclosed |