Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | ESR1 | P03372 | 4/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.63 |
| ▸ | ATM | Q13315 | 2/20 | 0.63 |
| ▸ | PGR | P06401 | 1/20 | 0.63 |
| ▸ | AR | P10275 | 1/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.63 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.63 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.63 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.63 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | HSD17B1 | P14061 | 5/20 | 0.53 |
| ▸ | RECQL | P46063 | 2/20 | 0.53 |
| ▸ | STS | P08842 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL351005 | 1.00 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL351004 | 1.00 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL11212923 | 0.92 | ESR1 (0.67) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL8519476 | 0.87 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL11481676 | 0.87 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL10349596 | 0.86 | MAPT (0.68) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL7518036 | 0.86 | MAPT (0.63) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL10349471 | 0.84 | MAPT (0.56) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL11213753 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2CYP3A4MAPTTP53ESR1 | |
| SCHEMBL11875916 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2CYP3A4MAPTTP53ESR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0033561-B1 | NOVEL 17-AMINO-16-HYDROXY STEROIDS OF THE ANDROSTANE AND OESTRANE SERIES AND DERIVATIVES THEREOF, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS | AKZO N.V. (NL) | 1983-05-11 | — | — | EP | disclosed |
| US-4330539-A | Novel 17-amino-16-hydroxy steroids of the androstane and oestrane series and derivatives thereof | AKZO NV (NL) | 1982-05-18 | — | — | US | disclosed |
| EP-0033561-A1 | Novel 17-amino-16-hydroxy steroids of the androstane and oestrane series and derivatives thereof, processes for their preparation and pharmaceutical compositions | AKZO N.V. (NL) | 1981-08-12 | — | — | EP | disclosed |