Nifedipine

Nifedipine

SCHEMBL27961697

COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ccccc1[N+](=O)[O-].[NaH]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1S

The experimentally established mechanism targets of Nifedipine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1C known ✓ Q13936 6/20 0.97
CACNA1F known ✓ O60840 2/20 0.97
CACNA1D known ✓ Q01668 2/20 0.97
CACNA1S known ✓ Q13698 2/20 0.97
ADORA3 P0DMS8 7/20 0.97
CYP1A2 P05177 6/20 0.97
CYP3A4 P08684 5/20 0.97
CYP2C9 P11712 5/20 0.97
CYP2C19 P33261 5/20 0.97
MAPT P10636 4/20 0.97
LMNA P02545 3/20 0.97
TSHR P16473 3/20 0.97
NFKB1 P19838 3/20 0.97
KMT2A Q03164 3/20 0.97
ABCC4 O15439 2/20 0.97
ABCB11 O95342 2/20 0.97
ADORA2A P29274 2/20 0.97
ADORA1 P30542 2/20 0.97
OPRM1 P35372 2/20 0.97
SCN1A P35498 2/20 0.97

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.

Compoundsimilaritytop predictedshared targets
Nifedipine SCHEMBL3968 0.99 ADORA3 (1.00) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL29349595 0.99 ADORA3 (1.00) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL1172946 0.99 ADORA3 (1.00) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL5694031 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL27076589 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL27076587 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL3858071 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL8851397 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL8851402 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL9759614 0.95 ADORA3 (0.93) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103720673-A Nifedipine sodium alginate sustained release tablet QINGDAO HYZLIN BIOLOGY DEV CO LTD 2014-04-16 CN claimed
CN-117180554-A Infusion control method, device and storage medium 深圳麦科田生物医疗技术股份有限公司 2023-12-08 CN disclosed
CN-106232144-B Solid dispersion 武田药品工业株式会社 2019-12-06 CN disclosed
CN-106420631-B A kind of preparation method of micropore sodium alginate-starch composite particles 青岛悦海医药科技有限公司 2019-03-22 CN disclosed
CN-106420631-A Preparation method of micro-pore sodium alginate-starch composite particles 青岛悦海医药科技有限公司 2017-02-22 CN disclosed
CN-103720673-A Nifedipine sodium alginate sustained release tablet QINGDAO HYZLIN BIOLOGY DEV CO LTD 2014-04-16 CN disclosed
CN-103720673-A Nifedipine sodium alginate sustained release tablet QINGDAO HYZLIN BIOLOGY DEV CO LTD 2014-04-16 CN disclosed
CN-103720673-A Nifedipine sodium alginate sustained release tablet QINGDAO HYZLIN BIOLOGY DEV CO LTD 2014-04-16 CN disclosed