Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | PGR | P06401 | 2/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9447841 | 0.88 | ALDH1A1 (0.36) | CYP19A1ESR1CHRM2SLC6A2SLC6A4 | |
| SCHEMBL9345759 | 0.76 | NR3C1 (0.30) | PGRAR | |
| SCHEMBL10449146 | 0.76 | CYP19A1 (0.52) | CYP19A1ESR1SLC6A4CYP2C19SHBG | |
| SCHEMBL9350104 | 0.76 | — | — | |
| SCHEMBL2507306 | 0.75 | CYP19A1 (0.40) | CYP19A1ESR1CHRM2SLC6A2SLC6A4 | |
| SCHEMBL4944917 | 0.69 | SHBG (0.36) | CYP19A1ESR1CHRM2SLC6A2SLC6A4 | |
| SCHEMBL9447842 | 0.67 | SHBG (0.37) | CYP19A1SHBG | |
| SCHEMBL9345789 | 0.66 | ALDH1A1 (0.35) | SLC6A4RAB9ASMN1; SMN2ALDH1A1LMNA | |
| Bolenol SCHEMBL636531 | 0.66 | ESR1 (0.71) | ESR1CHRM2SLC6A2SLC6A4CYP2C19 | |
| Bolenol SCHEMBL636530 | 0.66 | ESR1 (0.71) | ESR1CHRM2SLC6A2SLC6A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0532562-A1 | PROCESS FOR PRODUCING 10-g(b)-H-STEROIDS. | SCHERING AG (DE) | 1993-03-24 | — | — | EP | disclosed |