Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.64 |
| ▸ | SHBG | P04278 | 4/20 | 0.56 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.55 |
| ▸ | ESR1 | P03372 | 4/20 | 0.49 |
| ▸ | AR | P10275 | 4/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | GUSB | P08236 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12178073 | 1.00 | CYP19A1 (0.64) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL28117758 | 1.00 | CYP19A1 (0.64) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL11516179 | 0.85 | CYP19A1 (0.59) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL11516176 | 0.85 | CYP19A1 (0.59) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL11514918 | 0.84 | SHBG (0.60) | CYP19A1SHBGCYP17A1ARCYP2C19 | |
| SCHEMBL11518402 | 0.84 | SHBG (0.60) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL11518398 | 0.84 | SHBG (0.60) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL8024622 | 0.84 | CYP19A1 (0.58) | CYP19A1SHBGCYP17A1ESR1AR | |
| SCHEMBL11514201 | 0.78 | CYP19A1 (1.00) | CYP19A1SHBGESR1ARESR2 | |
| SCHEMBL11319086 | 0.78 | CYP19A1 (1.00) | CYP19A1SHBGESR1ARESR2 |
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 |