Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CNR2 | P34972 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.47 |
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
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 | 0.88 | ALDH1A1 (0.60) | ALDH1A1CNR2MAPTMEN1CYP1A2 | |
| SCHEMBL8645800 | 0.84 | CNR2 (0.55) | ALDH1A1CNR2MAPTMEN1CYP1A2 | |
| SCHEMBL27475357 | 0.79 | ALDH1A1 (0.51) | ALDH1A1CNR2MAPTMEN1CYP1A2 | |
| SCHEMBL8360559 | 0.74 | KDM4E (0.50) | ALDH1A1MAPTMEN1CYP1A2CYP2C19 | |
| SCHEMBL3001920 | 0.74 | PLA2G2A (0.67) | ALDH1A1MAPTMEN1CYP1A2CYP2C19 | |
| SCHEMBL27472762 | 0.74 | PTGS2 (0.53) | CNR2PLA2G2A | |
| SCHEMBL8648508 | 0.72 | ALDH1A1 (0.46) | ALDH1A1CNR2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL1921261 | 0.72 | PTGER4 (0.72) | ALDH1A1MAPTMEN1CYP1A2CYP2C19 | |
| SCHEMBL2006287 | 0.71 | PLA2G2A (0.66) | ALDH1A1MAPTMEN1CYP1A2CYP2C19 | |
| SCHEMBL8296288 | 0.70 | PLA2G2A (0.64) | ALDH1A1MAPTMEN1CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5877202-A | Indole derivatives useful to treat estrogen-related neoplasms and disorders | AVENTISUB II INC. | 1999-03-02 | — | — | US | disclosed |