Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11229072 | 0.92 | SMN1; SMN2 (0.59) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL11238883 | 0.90 | MAPT (0.60) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| Maleic Acid SCHEMBL11242848 | 0.90 | ESR1 (0.52) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL11209403 | 0.84 | ESR1 (0.57) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| Maleic Acid SCHEMBL11229073 | 0.81 | ESR1 (0.63) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL11224063 | 0.80 | SMN1; SMN2 (0.59) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| Maleic Acid SCHEMBL11238886 | 0.79 | MAPT (0.61) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL10327999 | 0.78 | ESR1 (0.67) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL10360572 | 0.77 | ESR1 (0.58) | SMN1; SMN2MAPTCYP3A4TP53ESR1 | |
| SCHEMBL11213690 | 0.76 | ESR1 (0.69) | SMN1; SMN2MAPTCYP3A4TP53ESR1 |
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-4330539-A | Novel 17-amino-16-hydroxy steroids of the androstane and oestrane series and derivatives thereof | AKZO NV (NL) | 1982-05-18 | — | — | US | claimed |