Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.80 |
| ▸ | CACNA1C | Q13936 | 7/20 | 0.80 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.80 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.80 |
| ▸ | MAPT | P10636 | 4/20 | 0.80 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.80 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.80 |
| ▸ | HTR2B | P41595 | 3/20 | 0.80 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.80 |
| ▸ | TSHR | P16473 | 3/20 | 0.80 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.80 |
| ▸ | DRD1 | P21728 | 3/20 | 0.80 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.80 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.80 |
| ▸ | LMNA | P02545 | 2/20 | 0.80 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.80 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL7381462 | 0.93 | CYP1A2 (0.69) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| SCHEMBL7379595 | 0.90 | CACNA1C (0.64) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL9322551 | 0.90 | ADORA3 (0.90) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL2156554 | 0.90 | ADORA3 (0.90) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL1172946 | 0.89 | ADORA3 (1.00) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL3968 | 0.89 | ADORA3 (1.00) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL29349595 | 0.89 | ADORA3 (1.00) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL8851402 | 0.88 | ADORA3 (0.97) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL3858071 | 0.88 | ADORA3 (0.97) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 | |
| Nifedipine SCHEMBL8851397 | 0.88 | ADORA3 (0.97) | ADORA3CACNA1CCYP1A2OPRM1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4284634-A | HYPOTENSIVE VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1981-08-18 | — | — | US | claimed |
| US-4525478-A | Certain 4-aryl-1,4-dihydro-3,5-pyridinedicarboxylates having vasodilating and anti-hypertensive properties | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1985-06-25 | — | — | US | disclosed |
| US-4370334-A | VASODILATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1983-01-25 | — | — | US | disclosed |
| US-4338322-A | 1,4-Dihydropyridine derivatives, pharmaceutical compositions containing same and methods of effecting vasodilation using same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1982-07-06 | — | — | US | disclosed |
| US-4284634-A | HYPOTENSIVE VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1981-08-18 | — | — | US | disclosed |