Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 4/20 | 0.59 |
| ▸ | ESR1 | P03372 | 7/20 | 0.58 |
| ▸ | AR | P10275 | 5/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 5/20 | 0.55 |
| ▸ | PGR | P06401 | 4/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11518186 | 1.00 | SHBG (0.59) | SHBGESR1ARESR2LMNA | |
| SCHEMBL9623224 | 0.89 | ABCB11 (0.47) | SHBGESR1ARESR2LMNA | |
| SCHEMBL10898740 | 0.86 | SHBG (0.56) | SHBGESR1ARESR2LMNA | |
| SCHEMBL9806099 | 0.86 | SHBG (0.56) | SHBGESR1ARESR2LMNA | |
| SCHEMBL11731128 | 0.83 | SHBG (0.53) | SHBGESR1ARESR2LMNA | |
| SCHEMBL11519269 | 0.83 | ESR1 (0.47) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL11519273 | 0.83 | ESR1 (0.47) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL11518398 | 0.81 | SHBG (0.60) | SHBGESR1ARESR2LMNA | |
| SCHEMBL11518402 | 0.81 | SHBG (0.60) | SHBGESR1ARESR2LMNA | |
| SCHEMBL11517418 | 0.80 | SHBG (0.59) | SHBGESR1ARESR2LMNA |
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-4150126-A | ANTITUMOR AND ANTICARCINOGENIC AGENTS AND ANIBODY INHIBITORS | AKTIEBOLAGET LEO (SE) | 1979-04-17 | — | — | US | disclosed |