Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 13/20 | 0.55 |
| ▸ | PTGDR | Q13258 | 8/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | RB1 | P06400 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 6/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | CCKAR | P32238 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15428827 | 0.89 | PTGDR2 (0.56) | PTGDR2PTGDRCYP2C9RB1CYP3A4 | |
| SCHEMBL3663657 | 0.89 | PTGDR2 (0.56) | PTGDR2PTGDRCYP2C9RB1CYP3A4 | |
| SCHEMBL15428833 | 0.83 | PTGDR2 (0.51) | PTGDR2PTGDRCYP2C9CYP3A4TBXA2R | |
| SCHEMBL233948 | 0.81 | PTGDR2 (0.65) | PTGDR2PTGDRCYP2C9CYP3A4TBXA2R | |
| SCHEMBL15428825 | 0.81 | PTGDR2 (0.56) | PTGDR2PTGDRCYP2C9CYP3A4TBXA2R | |
| SCHEMBL13278872 | 0.81 | DRD2 (0.45) | PTGDR2PTGDRCYP2C9RB1DRD2 | |
| SCHEMBL2189400 | 0.79 | RB1 (0.36) | PTGDR2PTGDRCYP2C9RB1CYP3A4 | |
| SCHEMBL13281925 | 0.78 | CYP2C9 (0.42) | PTGDR2PTGDRCYP2C9RB1CYP3A4 | |
| SCHEMBL2186860 | 0.76 | PTGDR2 (0.64) | PTGDR2PTGDRCYP2C9CYP3A4 | |
| SCHEMBL15436634 | 0.75 | PTGDR2 (0.52) | PTGDR2PTGDRCYP2C9CYP3A4TBXA2R |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346865-B1 | INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS | MERCK CANADA INC (CA) | 2015-07-15 | — | — | EP | disclosed |
| US-8637671-B2 | Indole derivatives as CRTH2 receptor antagonists | MERCK CANADA INC. (CA) | 2014-01-28 | — | — | US | disclosed |