Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | GUSB | P08236 | 1/20 | 0.55 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.53 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.51 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.50 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.50 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8108247 | 0.86 | ALDH1A1 (0.63) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL19732964 | 0.86 | ALDH1A1 (0.63) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL7265815 | 0.85 | ALDH1A1 (0.83) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL9805503 | 0.83 | ALDH1A1 (0.59) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL9805495 | 0.83 | ALDH1A1 (0.59) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL9805484 | 0.80 | ALDH1A1 (0.56) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL9805492 | 0.80 | ALDH1A1 (0.56) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C | |
| SCHEMBL3032197 | 0.79 | CACNA1F (0.71) | LMNACACNA1CPDE1CCACNA1FCACNA1D | |
| SCHEMBL3940339 | 0.79 | CACNA1F (0.71) | LMNACACNA1CPDE1CCACNA1FCACNA1D | |
| SCHEMBL10743987 | 0.79 | CACNA1C (0.79) | ALDH1A1LMNAL3MBTL1GUSBCACNA1C |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0253178-B1 | SUBSTITUTED 1,5-BENZODIAZEPINE COMPOUNDS | E.R. Squibb & Sons, Inc. (US) | 1991-08-14 | — | — | EP | disclosed |
| EP-0253178-A1 | Substituted 1,5-benzodiazepine compounds | E.R. Squibb & Sons, Inc. (US) | 1988-01-20 | — | — | EP | disclosed |
| US-4650797-A | HYPOTENSIVES | E. R. SQUIBB & SONS, INC. (US) | 1987-03-17 | — | — | US | disclosed |
| US-4647561-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1987-03-03 | — | — | US | disclosed |
| EP-0211429-A1 | 1,5-Benzodiazepine compounds | E.R. Squibb & Sons, Inc. (US) | 1987-02-25 | — | — | EP | disclosed |