Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 6/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MAP2 | P11137 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6168700 | 0.89 | PTGS2 (0.58) | PTGS1PTGS2KDM4ETSHR | |
| SCHEMBL6170087 | 0.88 | PTGS2 (0.55) | PTGS1PTGS2KDM4EMAP2TSHR | |
| SCHEMBL7411140 | 0.85 | KDM4E (0.71) | PTGS1PTGS2KDM4EMAP2TSHR | |
| SCHEMBL28401795 | 0.84 | MAP2 (0.46) | PTGS1PTGS2KDM4EMAP2MEN1 | |
| SCHEMBL4257382 | 0.83 | KDM4E (0.60) | KDM4EALDH1A1GAAMAPT | |
| SCHEMBL6169798 | 0.80 | PTGS2 (0.51) | PTGS1PTGS2KDM4EALDH1A1GAA | |
| SCHEMBL6171391 | 0.79 | PTGS2 (0.58) | PTGS1PTGS2KDM4E | |
| SCHEMBL8174607 | 0.78 | KDM4E (0.54) | PTGS1PTGS2KDM4EMEN1ALDH1A1 | |
| SCHEMBL6170413 | 0.77 | KDM4E (0.60) | PTGS2KDM4EMAP2MEN1ALDH1A1 | |
| SCHEMBL6171629 | 0.77 | KDM4E (0.53) | PTGS2KDM4EMAP2MEN1ALDH1A1 |
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-0746544-A1 | NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS | MERRELL PHARMACEUTICALS INC. (US) | 1996-12-11 | — | — | EP | disclosed |
| WO-1995022524-A1 | NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS | MERRELL PHARMACEUTICALS INC. (US) | 1995-08-24 | — | — | WO | disclosed |