Nifedipine

Nifedipine

SCHEMBL8851402

COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ccccc1[N+](=O)[O-].[CaH2]

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 SCHEMBL1172946 0.99 ADORA3 (1.00) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL29349595 0.99 ADORA3 (1.00) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL3968 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 SCHEMBL8851397 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL27961697 0.97 ADORA3 (0.97) ADORA3CYP1A2CACNA1CCYP3A4CYP2C9
Nifedipine SCHEMBL3858071 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2263670-B1 Use of angiotensin II receptor antagonists in order to increase insulin sensitivity BOEHRINGER INGELHEIM PHARMA (DE) 2015-09-09 EP claimed
CN-111643473-B Nifedipine sustained release tablet and preparation method thereof 华润双鹤利民药业(济南)有限公司 2022-05-27 CN disclosed
CN-114384170-A Method for determining concentration of amlodipine in blood plasma by liquid chromatography-mass spectrometry 安徽万邦医药科技股份有限公司 2022-04-22 CN disclosed
CN-113197851-A Pharmaceutical suspensions containing drug particles, devices for their administration, and methods of use thereof 辛纳吉勒公司 2021-08-03 CN disclosed
CN-107847722-B Pharmaceutical suspensions containing drug particles, devices for their administration, and methods of use thereof 辛纳吉勒公司 2021-05-18 CN disclosed
CN-107213138-B Method and pharmaceutical composition for treating hypertension by timed release of drugs 北京罗诺强施医药技术研发中心有限公司 2020-12-18 CN disclosed
CN-111643473-A Nifedipine sustained release tablet and preparation method thereof 华润双鹤利民药业(济南)有限公司 2020-09-11 CN disclosed
EP-3191105-A1 SULFATE SALT SOLUTION LAXATIVE COMPOSITIONS AND METHODS OF USE THEREOF Braintree Laboratories, Inc. (US) 2017-07-19 EP disclosed
WO-2016040733-A1 SULFATE SALT SOLUTION LAXATIVE COMPOSITIONS AND METHODS OF USE THEREOF BRAINTREE LABORATORIES, INC. (US) 2016-03-17 WO disclosed
CN-102203074-A Aryl GPR119 agonists and uses thereof METABOLEX INC 2011-09-28 CN disclosed
CN-102026636-A Oxymethylene aryl compounds and uses thereof METABOLEX INC 2011-04-20 CN disclosed
CN-101754962-A N-azacyclic substituted pyrrole, imidazole, triazole and tetrazole derivatives as agonists of the RUP3 or GPR119 for the treatment of diabetes and metabolic disorders METABOLEX INC 2010-06-23 CN disclosed
CN-101616586-A The heterocyclic receptor agonists of treatment diabetes and metabolic disorder METABOLEX INC 2009-12-30 CN disclosed
CN-101095682-A Oral preparations of ivabradine or the medical salt thereof BEIJING BENCAO TIANYUAN MEDICA (CN) 2008-01-02 CN disclosed
US-5650394-A Use of urinastatin-like compounds to prevent premature delivery ADEZA BIOMEDICAL (US) 1997-07-22 US disclosed
EP-0732932-A1 USE OF URINASTATIN-LIKE COMPOUNDS TO PREVENT PREMATURE DELIVERY ADEZA BIOMEDICAL (US) 1996-09-25 EP disclosed
WO-1996026273-A1 POLYPEPTIDES DERIVED FROM URINASTATIN HAVING CALCIUM CHANNEL BLOCKING ACTIVITY AND THEIR USE TO DELAY PREMATURE DELIVERY ADEZA BIOMEDICAL CORPORATION (US) 1996-08-29 WO disclosed
WO-1995012406-A9 USE OF URINASTATIN-LIKE COMPOUNDS TO PREVENT PREMATURE DELIVERY 1996-06-13 WO disclosed
WO-1995012406-A1 USE OF URINASTATIN-LIKE COMPOUNDS TO PREVENT PREMATURE DELIVERY ADEZA BIOMEDICAL (US) 1995-05-11 WO disclosed
WO-1995011894-A1 HISTAMINE H3-RECEPTOR ANTAGONISTS AND THERAPEUTIC USES THEREOF THE UNIVERSITY OF TOLEDO (US) 1995-05-04 WO disclosed