Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7891309 | 0.81 | ESR1 (0.36) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL6463142 | 0.79 | ESR1 (0.55) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL7887023 | 0.77 | ESR1 (0.31) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL3749631 | 0.75 | SHBG (0.43) | ESR1MAPTLMNAMAPK1PGR | |
| SCHEMBL7885450 | 0.74 | LMNA (0.35) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL2835200 | 0.73 | ALOX15 (0.53) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL9169476 | 0.70 | ESR1 (0.53) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL7887025 | 0.69 | ESR1 (0.32) | ESR1ALOX15MAPTLMNAMAPK1 | |
| SCHEMBL7891335 | 0.68 | ESR1 (0.34) | ESR1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL2835312 | 0.67 | MAPT (0.49) | ESR1ALOX15MAPTLMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1163259-A1 | 14.BETA.,17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS | Akzo Nobel N.V. (NL) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000053619-A1 | 14.BETA., 17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS | AKZO NOBEL N.V. (NL) | 2000-09-14 | — | — | WO | disclosed |