Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7495907 | 1.00 | NPC1 (0.55) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8458268 | 0.98 | NPC1 (0.56) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8458977 | 0.94 | NPC1 (0.59) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8458703 | 0.94 | NPC1 (0.59) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8460808 | 0.93 | ALDH1A1 (0.57) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8339910 | 0.92 | NPC1 (0.50) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7502103 | 0.88 | NPC1 (0.66) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7503318 | 0.87 | MMP2 (0.58) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL9681370 | 0.83 | SMN1; SMN2 (0.64) | NPC1MAPTSMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL30374771 | 0.81 | HPGD (0.71) | NPC1MAPTSMN1; SMN2ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999025706-A1 | 2-ARYL-3-AROYLBENZO[B]THIOPHENES USEFUL FOR THE TREATMENT OF ESTROGEN DEPRIVATION SYNDROME | ELI LILLY AND COMPANY (US) | 1999-05-27 | — | — | WO | claimed |
| WO-1999025706-A1 | 2-ARYL-3-AROYLBENZO[B]THIOPHENES USEFUL FOR THE TREATMENT OF ESTROGEN DEPRIVATION SYNDROME | ELI LILLY AND COMPANY (US) | 1999-05-27 | — | — | WO | disclosed |