Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2907680 | 1.00 | ALDH1A1 (0.42) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL3733817 | 0.98 | ADRB2 (0.41) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL2835530 | 0.94 | ALDH1A1 (0.41) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL9035818 | 0.94 | SMN1; SMN2 (0.38) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL9776380 | 0.93 | ALDH1A1 (0.41) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL11041022 | 0.92 | ALDH1A1 (0.39) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL11037986 | 0.91 | ALDH1A1 (0.38) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL6247312 | 0.90 | MAPT (0.33) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL42565 | 0.88 | ALDH1A1 (0.45) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A | |
| SCHEMBL8582641 | 0.88 | ALDH1A1 (0.45) | ALDH1A1ADRB2ADRB1ADRB3FKBP1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0763053-A4 | STEROID DERIVATIVES FOR TREATMENT OF 5 ALPHA REDUCTASE | SMITHKLINE BEECHAM CORP (US) | 1998-09-09 | — | — | EP | disclosed |
| EP-0763053-A1 | STEROID DERIVATIVES FOR TREATMENT OF 5 ALPHA REDUCTASE | SMITHKLINE BEECHAM CORPORATION (US) | 1997-03-19 | — | — | EP | disclosed |
| EP-0721454-A1 | NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST | J. URIACH & CIA. S.A. (ES) | 1996-07-17 | — | — | EP | disclosed |
| WO-1995033761-A1 | STEROID DERIVATIVES FOR TREATMENT OF 5 ALPHA REDUCTASE | SMITHKLINE BEECHAM CORPORATION (US) | 1995-12-14 | — | — | WO | disclosed |