Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | RGS12 | O14924 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8649405 | 0.85 | ALDH1A1 (0.60) | CNR2PTGS2AKR1C3ALDH1A1MEN1 | |
| SCHEMBL8360558 | 0.84 | ALDH1A1 (0.50) | CNR2ALDH1A1MEN1CYP1A2MAPT | |
| SCHEMBL27472762 | 0.83 | PTGS2 (0.53) | CNR2PTGS2PLA2G2A | |
| SCHEMBL8292638 | 0.80 | MAPT (0.63) | CNR2PTGS2AKR1C3ALDH1A1MEN1 | |
| SCHEMBL27475357 | 0.80 | ALDH1A1 (0.51) | CNR2ALDH1A1MEN1CYP1A2MAPT | |
| SCHEMBL4373628 | 0.78 | PLA2G2A (0.58) | ALDH1A1MEN1CYP1A2MAPTCYP2C19 | |
| SCHEMBL27474027 | 0.77 | GSK3B (0.39) | CNR2PTGS2AKR1C3ALDH1A1MEN1 | |
| SCHEMBL4565641 | 0.76 | LMNA (0.58) | CNR2PTGS2AKR1C3ALDH1A1MEN1 | |
| SCHEMBL8292072 | 0.76 | PLA2G2A (0.61) | ALDH1A1MEN1CYP1A2MAPTCYP2C19 | |
| SCHEMBL8296288 | 0.76 | PLA2G2A (0.64) | PTGS2ALDH1A1MEN1CYP1A2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0746544-B1 | NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS | MERRELL PHARMA INC (US) | 1998-09-09 | — | — | EP | disclosed |
| 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 |