Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 8/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 8/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8360194 | 0.89 | TSHR (0.39) | MTNR1AMTNR1BALDH1A1 | |
| SCHEMBL8360481 | 0.88 | KMT2A (0.41) | ALDH1A1 | |
| SCHEMBL8354381 | 0.85 | ALDH1A1 (0.51) | MTNR1AMTNR1BHTR6BCHEACHE | |
| SCHEMBL8360169 | 0.74 | ALDH1A1 (0.52) | BCHEACHEALDH1A1PLA2G2A | |
| SCHEMBL8356260 | 0.74 | ALDH1A1 (0.52) | BCHEACHEALDH1A1PLA2G2A | |
| SCHEMBL8361042 | 0.74 | ALDH1A1 (0.52) | BCHEACHEALDH1A1PLA2G2A | |
| SCHEMBL14489607 | 0.74 | MAOA (0.51) | BCHEACHEALDH1A1PLA2G2A | |
| SCHEMBL13843431 | 0.72 | PLA2G2A (0.49) | BCHEACHEPLA2G2A | |
| SCHEMBL13986773 | 0.72 | DYRK1A (0.52) | BCHEACHE | |
| SCHEMBL8645929 | 0.72 | BCHE (0.44) | BCHEACHEALDH1A1CYP1A2CYP2D6 |
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 |