Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.72 |
| ▸ | LMNA | P02545 | 7/20 | 0.72 |
| ▸ | MAPT | P10636 | 6/20 | 0.72 |
| ▸ | SHBG | P04278 | 5/20 | 0.72 |
| ▸ | TSHR | P16473 | 5/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.72 |
| ▸ | SERPINA6 | P08185 | 4/20 | 0.72 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.72 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.72 |
| ▸ | PGR | P06401 | 4/20 | 0.72 |
| ▸ | AR | P10275 | 4/20 | 0.72 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.72 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.72 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.72 |
| ▸ | SNCA | P37840 | 2/20 | 0.72 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.72 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.72 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL6462109 | 1.00 | CYP3A4 (0.72) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL13310373 | 1.00 | CYP3A4 (0.72) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL9351748 | 1.00 | CYP3A4 (0.72) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL19635112 | 0.91 | CYP3A4 (0.69) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL22475606 | 0.91 | CYP3A4 (0.69) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL20402646 | 0.91 | CYP3A4 (0.69) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL21367235 | 0.91 | CYP3A4 (0.69) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL10796253 | 0.91 | CYP3A4 (0.69) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL15672642 | 0.89 | CYP3A4 (0.70) | CYP3A4LMNAMAPTSHBGTSHR | |
| SCHEMBL14150045 | 0.89 | CYP3A4 (0.70) | CYP3A4LMNAMAPTSHBGTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6881728-B1 | 14-β, 17-α-hydroxymethylandrostane derivatives as androgens | AKZO NOBEL N.V. (NL) | 2005-04-19 | — | — | US | disclosed |
| EP-1163259-B1 | 14.BETA.,17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS | AKZO NOBEL NV (NL) | 2002-11-20 | — | — | EP | disclosed |
| EP-0375351-B1 | Phosphonic acid substituted steroids as steroid 5alpha-reductase inhibitors | SMITHKLINE BEECHAM CORP (US) | 1994-08-31 | — | — | EP | disclosed |
| EP-0289327-B1 | STEROID 5-ALPHA-REDUCTASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1991-12-18 | — | — | EP | disclosed |
| US-5017568-A | Enzyme inhibitors, carboxylation | SMITHKLINE BEECHAM CORPORATION (US) | 1991-05-21 | — | — | US | disclosed |
| US-4946834-A | ACRYLATE ANALOGUES OF STEROIDAL SYNTHETIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1990-08-07 | — | — | US | disclosed |
| EP-0375351-A1 | Phosphonic acid substituted steroids as steroid 5alpha-reductase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1990-06-27 | — | — | EP | disclosed |
| US-4910226-A | Estrane compound | SMITHKLINE BECKMAN CORPORATION (US) | 1990-03-20 | — | — | US | disclosed |
| EP-0289327-A2 | Steroid 5-alpha-reductase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1988-11-02 | — | — | EP | disclosed |
| US-4317817-A | SKIN DISORDERS; ACEME; ENZYME INHIBITORS | RICHARDSON-MERRELL INC. (US) | 1982-03-02 | — | — | US | disclosed |