Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3022593 | 0.84 | ADORA3 (0.59) | NR3C2ADORA3CACNA1FCACNA1DCACNA1S | |
| SCHEMBL9502874 | 0.81 | CACNA1B (0.58) | NR3C2ADORA3CACNA1FCACNA1DCACNA1S | |
| SCHEMBL10439079 | 0.73 | NR3C2 (0.47) | NR3C2ADORA3CACNA1FCACNA1DCACNA1S | |
| SCHEMBL9505249 | 0.73 | ALDH1A1 (0.67) | ADORA3CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL10830291 | 0.72 | ALDH1A1 (0.74) | NR3C2ADORA3CACNA1FCACNA1DCACNA1S | |
| SCHEMBL3024964 | 0.72 | NR3C2 (0.51) | NR3C2MEN1KMT2AALDH1A1ADORA2B | |
| SCHEMBL3027936 | 0.72 | CACNA1F (0.56) | NR3C2CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL3016210 | 0.72 | ABCC1 (0.68) | NR3C2CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL3034907 | 0.70 | NR3C2 (0.61) | NR3C2ADORA3CACNA1FCACNA1DCACNA1S | |
| SCHEMBL3018702 | 0.70 | NR3C2 (0.61) | NR3C2CACNA1B |
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-0458823-B1 | A PROCESS FOR PREPARATION OF ENANTIOMERICALLY PURE POLYSUBSTITUTED 1,4-DIHYDROPYRIDINES | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1993-10-13 | — | — | EP | disclosed |
| US-5245039-A | PROCESS FOR PREPARATION OF ENANTIOMERICALLY PURE POLYSUBSTITUTED 1,4-DIHYDROPYRIDINES | BOEHRINGER MANNHEIM ITALIA (IT) | 1993-09-14 | — | — | US | disclosed |
| WO-1990009376-A1 | A PROCESS FOR PREPARATION OF ENANTIOMERICALLY PURE POLYSUBSTITUTED 1,4-DIHYDROPYRIDINES | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1990-08-23 | — | — | WO | disclosed |
| EP-0383320-A1 | A process for preparation of enantiomerically pure polysubstituted 1,4-dihydropyridines | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1990-08-22 | — | — | EP | disclosed |