Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | PYGM | P11217 | 2/20 | 0.52 |
| ▸ | PYGL | P06737 | 1/20 | 0.52 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.51 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.51 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | DHFR | P00374 | 1/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11669396 | 0.92 | ADORA3 (0.68) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL10684386 | 0.85 | ADORA3 (0.75) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL14616736 | 0.81 | ADORA3 (0.85) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL11669538 | 0.81 | CACNA1D (0.57) | ADORA3KDM4ECACNA1DCACNA1FCACNA1S | |
| SCHEMBL11522526 | 0.80 | CYP2C9 (0.56) | ADORA3KDM4EGAAPYGMPYGL | |
| SCHEMBL8955489 | 0.80 | ADORA3 (0.63) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL11691621 | 0.80 | ADORA3 (0.56) | ADORA3KDM4EGAACACNA1DALDH1A1 | |
| SCHEMBL11004678 | 0.79 | CACNA1F (0.63) | ADORA3KDM4EPYGMPYGLCACNA1D | |
| SCHEMBL3027412 | 0.79 | ADORA3 (0.89) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL11688000 | 0.79 | ADORA3 (0.62) | ADORA3KDM4EGAACACNA1DCACNA1F |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3957998-A | ADMINISTERING | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-18 | — | — | US | claimed |
| US-4049662-A | HYPOTENSIVE AGENTS, VASODILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-20 | — | — | US | disclosed |
| US-4016277-A | ANTIHYPERTENSIVE AGENTS AND CORONARY VESSEL DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-04-05 | — | — | US | disclosed |
| US-4002762-A | 2-Amino-3,4-dihydropyridines used to effect coronary vessel dilation and treat hypertension | BAYER AKTIENGESELLSCHAFT (DT) | 1977-01-11 | — | — | US | disclosed |
| US-4001252-A | HYPOTENSIVES, CORONARY DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-01-04 | — | — | US | disclosed |
| US-3988458-A | HYPOTENSIVE, CORONARY DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-10-26 | — | — | US | disclosed |
| US-3959474-A | 2,6-Diamino-1,4-dihydropyridine-3,5-dicarboxylic acid esters used as coronary vessel dilators and anti-hypertensive agents | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-25 | — | — | US | disclosed |
| US-3957998-A | ADMINISTERING | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-18 | — | — | US | disclosed |
| US-3950336-A | HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-04-13 | — | — | US | disclosed |