Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | AR | P10275 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.56 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10949241 | 1.00 | PGR (0.56) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| Potassium Ion SCHEMBL10949247 | 0.91 | PGR (0.62) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL10952025 | 0.82 | CYP17A1 (0.52) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL10952019 | 0.82 | CYP17A1 (0.52) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL19628769 | 0.82 | PGR (0.66) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL11326826 | 0.82 | PGR (0.66) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL8396014 | 0.82 | PGR (0.66) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL6840979 | 0.78 | CYP3A4 (0.55) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL6840982 | 0.78 | CYP3A4 (0.55) | PGRCYP3A4ARALDH1A1CYP2C19 | |
| SCHEMBL17889177 | 0.77 | AR (0.62) | PGRCYP3A4ARALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4542024-A | ANTIALDOSTERONES | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-09-17 | — | — | US | claimed |
| US-4542024-A | ANTIALDOSTERONES | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-09-17 | — | — | US | disclosed |