Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 9/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 6/20 | 0.42 |
| ▸ | PTGDR | Q13258 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | CCKAR | P32238 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | IGF1R | P08069 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7586678 | 0.84 | PTGDR2 (0.44) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| SCHEMBL7590132 | 0.81 | PTGDR2 (0.43) | PTGDR2TBXA2RPTGDRALDH1A1MEN1 | |
| SCHEMBL16561901 | 0.79 | PTGDR2 (0.65) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| SCHEMBL832500 | 0.79 | PTGDR2 (0.65) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| SCHEMBL13273561 | 0.78 | KDM4E (0.67) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL3020304 | 0.78 | PTGDR2 (0.64) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| SCHEMBL16559078 | 0.78 | KDM4E (0.67) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL3020302 | 0.78 | PTGDR2 (0.64) | PTGDR2TBXA2RPTGDRKDM4EALDH1A1 | |
| SCHEMBL27920957 | 0.76 | KDM4E (0.50) | PTGDR2KDM4EALDH1A1HTR6MEN1 | |
| SCHEMBL13677407 | 0.76 | PTGDR2 (0.52) | PTGDR2TBXA2RPTGDRKDM4EMEN1 |
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-0728743-B1 | 3-Amino-tetrahydrocarbazol propanoic acid esters | BAYER AG (DE) | 2002-10-30 | — | — | EP | disclosed |
| EP-0728743-A1 | 3-Amino-tetrahydrocarbazol propanoic acid esters | BAYER AG (DE) | 1996-08-28 | — | — | EP | disclosed |