Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 7/20 | 0.49 |
| ▸ | PGR | P06401 | 7/20 | 0.49 |
| ▸ | AR | P10275 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 6/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10705553 | 1.00 | CYP3A4 (0.49) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10707927 | 0.92 | CYP3A4 (0.44) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10711533 | 0.90 | NR3C1 (0.48) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10705817 | 0.90 | CYP3A4 (0.53) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10707897 | 0.88 | CYP3A4 (0.40) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10704042 | 0.88 | CYP3A4 (0.56) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL10705824 | 0.86 | CYP3A4 (0.42) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL853001 | 0.82 | LMNA (0.67) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL9622429 | 0.82 | LMNA (0.67) | CYP3A4NR3C1PGRARSMN1; SMN2 | |
| SCHEMBL13941337 | 0.82 | LMNA (0.67) | CYP3A4NR3C1PGRARSMN1; SMN2 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0104549-B1 | AZOLYL BUTANOLES | BAYER AG (DE) | 1987-07-29 | — | — | EP | claimed |
| EP-0104549-A2 | Azolyl butanoles | BAYER AG (DE) | 1984-04-04 | — | — | EP | claimed |
| EP-0153270-B1 | 1-ALPHA, 2-ALPHA-METHYLENE-6-METHYLENE AND 6-ALPHA-METHYL PREGNENES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-07-27 | — | — | EP | disclosed |
| EP-0104549-B1 | AZOLYL BUTANOLES | BAYER AG (DE) | 1987-07-29 | — | — | EP | disclosed |
| EP-0104549-B1 | AZOLYL BUTANOLES | BAYER AG (DE) | 1987-07-29 | — | — | EP | disclosed |
| US-4670427-A | ANTIANDROGENS | SCHERING AKTIENGESELLSCHAFT (DE) | 1987-06-02 | — | — | US | disclosed |
| EP-0153270-A2 | 1-Alpha, 2-alpha-methylene-6-methylene and 6-alpha-methyl pregnenes, process for their preparation and pharmaceutical compositions containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-08-28 | — | — | EP | disclosed |
| EP-0104549-A2 | Azolyl butanoles | BAYER AG (DE) | 1984-04-04 | — | — | EP | disclosed |
| EP-0104549-A2 | Azolyl butanoles | BAYER AG (DE) | 1984-04-04 | — | — | EP | disclosed |
| EP-0104549-A2 | Azolyl butanoles | BAYER AG (DE) | 1984-04-04 | — | — | EP | disclosed |