Lopinavir

Lopinavir

SCHEMBL21775

Cc1cccc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)N1CCCNC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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The experimentally established mechanism targets of Lopinavir. 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
CYP3A4 P08684 4/20 1.00
ABCC3 O15438 1/20 1.00
ABCC4 O15439 1/20 1.00
ABCB11 O95342 1/20 1.00
PGR P06401 1/20 1.00
ABCB1 P08183 1/20 1.00
ADORA3 P0DMS8 1/20 1.00
CHRM1 P11229 1/20 1.00
TBXA2R P21731 1/20 1.00
ADRA1A P35348 1/20 1.00
OPRM1 P35372 1/20 1.00
HTR2B P41595 1/20 1.00
KCNH2 Q12809 1/20 1.00
SCN5A Q14524 1/20 1.00
ABCG2 Q9UNQ0 1/20 1.00
CA2 P00918 1/20 0.40
CTSD P07339 4/20 0.39
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35

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
Lopinavir SCHEMBL673770 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL825826 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL28365789 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL13065521 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL18898529 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL3042268 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL13370718 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL22241592 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL22382744 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR
Lopinavir SCHEMBL12270816 1.00 CYP3A4 (1.00) CYP3A4ABCC3ABCC4ABCB11PGR

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

Appears in 32390 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4228644-B1 N-[4-[1-(1,4-DIOXASPIRO[4.5]DEC-8-YL)-4-(8-OXA-3-AZABICYCLO[3.2.1]OCT-3-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]PHENYL]-N'-METHYLUREA FOR USE IN THE TREATMENT OF COVID19 NANTCELL INC (US) 2026-05-27 EP claimed
CN-122094963-A Cardioprotective lipids and methods of use 2026-05-26 CN claimed
US-20260139035-A1 HUMAN ANTIBODY AGAINST CORONAVIRUS VARIANTS OR ANTIGEN-BINDING FRAGMENT THEREOF NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2026-05-21 US claimed
US-20260139860-A1 PRODUCTS OF MANUFACTURE FOR THE TREATMENT, PREVENTION AND AMELIORATION OF MICROBIAL INFECTIONS CENTRE FOR DIGESTIVE DISEASES (AU) 2026-05-21 US claimed
EP-4094767-B1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO UNIV EMORY (US) 2026-05-20 EP claimed
US-12629363-B2 Prophylaxis and treatment of angioedema PHARVARIS GMBH (CH) 2026-05-19 US claimed
WO-2026101812-A1 HIV INTEGRASE INHIBITORS FOR TREATMENT OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-15 WO claimed
WO-2026102345-A1 METHODS OF ADMINISTERING THE VOLTAGE-GATED POTASSIUM CHANNEL OPENER AZETUKALNER XENON PHARMACEUTICALS INC. (CA) 2026-05-15 WO claimed
EP-3829559-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-13 EP claimed
US-20260124290-A1 HIV Immunogens, Vaccines, and Methods Related Thereto UNIV EMORY (US) 2026-05-07 US claimed
WO-2002056861-A2 SYNTACTIC DEFORMABLE FOAM COMPOSITIONS AND METHODS FOR MAKING INTELLIPHARMACEUTICS CORP. (CA) 2002-07-25 WO claimed
WO-2002053138-A2 TREATMENT FOR INHIBITING NEOPLASTIC LESIONS USING INCENSOLE AND/OR FURANOGERMACRENS SHANAHAN-PRENDERGAST ELISABETH (IE) 2002-07-11 WO claimed
US-20020090445-A1 Containing lopinavir or its mixtures, comprising a sweetener, two or more flavoring agents menthol, peppermint, vanilla, cotton candy flavors, and flavor modifier such as sodium citrate, sodium chloride and citric acid ABBVIE INC. 2002-07-11 US claimed
US-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections PHARMASSET, INC. 2002-05-09 US claimed
WO-2002033402-A2 ESTABLISHMENT OF BIOLOGICAL CUT-OFF VALUES FOR PREDICTING RESISTANCE TO THERAPY VIRCO BVBA (BE) 2002-04-25 WO claimed
WO-2002020057-A2 FLAVORING SYSTEMS FOR PHARMACEUTICAL COMPOSITIONS AND METHODS OF MAKING SUCH COMPOSITIONS ABBOTT LABORATORIES (US) 2002-03-14 WO claimed
WO-2001097749-A2 THE USE OF SYNTHETIC, NON-HORMONAL 21-AMINOSTEROIDS AND THEREOF KOTZE, GAVIN, SALOMON (ZA) 2001-12-27 WO claimed
US-20010051721-A1 Hydrated forms of lopinavir; HIV protease inhibitor ABBVIE INC. 2001-12-13 US claimed
WO-2001079246-A2 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF HEPATITIS VIRUS INFECTIONS PHARMASSET, LTD. (BB) 2001-10-25 WO claimed
WO-2001074787-A2 CRYSTALLINE PHARMACEUTICAL ABBOTT LABORATORIES (US) 2001-10-11 WO claimed