Saquinavir

Saquinavir

SCHEMBL6881

CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

pol

The experimentally established mechanism targets of Saquinavir. 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 6/20 1.00
ABCC4 O15439 2/20 1.00
ABCB11 O95342 2/20 1.00
ABCB1 P08183 2/20 1.00
TACR2 P21452 2/20 1.00
TBXAS1 P24557 2/20 1.00
OPRM1 P35372 2/20 1.00
OPRD1 P41143 2/20 1.00
OPRK1 P41145 2/20 1.00
SLC6A3 Q01959 2/20 1.00
KCNH2 Q12809 2/20 1.00
ABCG2 Q9UNQ0 2/20 1.00
ABCC3 O15438 1/20 1.00
CACNA1F O60840 1/20 1.00
HTR1A P08908 1/20 1.00
DRD2 P14416 1/20 1.00
DRD3 P35462 1/20 1.00
AVPR1A P37288 1/20 1.00
HTR2B P41595 1/20 1.00
CACNA1D Q01668 1/20 1.00

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
Saquinavir SCHEMBL29534530 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL1176566 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL13575784 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL1976548 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL20451344 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL8584255 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL8584252 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL13953012 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL21683360 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2
Saquinavir SCHEMBL29357501 1.00 CYP3A4 (1.00) CYP3A4ABCC4ABCB11ABCB1TACR2

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 43534 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094963-A Cardioprotective lipids and methods of use 2026-05-26 CN 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-2026102345-A1 METHODS OF ADMINISTERING THE VOLTAGE-GATED POTASSIUM CHANNEL OPENER AZETUKALNER XENON PHARMACEUTICALS INC. (CA) 2026-05-15 WO claimed
US-20260124290-A1 HIV Immunogens, Vaccines, and Methods Related Thereto UNIV EMORY (US) 2026-05-07 US claimed
EP-4255391-B1 LUMINOL FOR USE IN THE TREATMENT OF SEQUELAE OF A SARS-COV-2 INFECTION METRIOPHARM AG (CH) 2026-05-06 EP claimed
US-12617809-B2 Cardioprotective lipid and method of use SIGNPATH PHARMA, INC. (US) 2026-05-05 US claimed
WO-2026085583-A1 MOLECULAR ASSAY FOR DETECTING HIV-1 DRUG-RESISTANT MUTATIONS ST VINCENT'S HOSPITAL SYDNEY LIMITED (AU) 2026-04-30 WO claimed
WO-2026086804-A1 MULTILAYER-REGULATED GENE EDITING SYSTEM AND USE THEREOF 自如基因科技(深圳)有限公司 2026-04-30 WO claimed
CN-1132756-A Antiviral ethers of aspartate protease substrate isosteres CIBA GEIGY AG (CH) 1996-10-09 CN claimed
EP-0728481-A2 Use of quinoxaline and protease inhibitors in a composition for the treatment of AIDS and/or HIV infections BAYER AG (DE) 1996-08-28 EP claimed
WO-1996022368-A1 RIBOZYMES TARGETING THE RETROVIRAL PACKAGING SEQUENCE EXPRESSION CONSTRUCTS AND RECOMBINANT RETROVIRUSES CONTAINING SUCH CONSTRUCTS GENE SHEARS PTY. LTD. (AU) 1996-07-25 WO claimed
EP-0432694-B1 Aminoalcohols HOFFMANN LA ROCHE (CH) 1996-05-29 EP claimed
WO-1996010399-A1 LIPOSOME-FORMULATIONS FOR TREATMENT OF VIRAL DISEASES BERGERON MICHEL G (CA) 1996-04-11 WO claimed
US-5484801-A Pharmaceutical composition for inhibiting HIV protease ABBOTT LABORATORIES (US) 1996-01-16 US claimed
WO-1995024385-A1 SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 1995-09-14 WO claimed
EP-0432695-B1 Amino acid derivatives HOFFMANN LA ROCHE (CH) 1995-05-17 EP claimed
US-5196438-A Viricides; e.g. N-tert.butyl-decahydro-2-(2(R)-hydroxy-4-phenyl-3(S)-((N-(2 -quinolylcarbonyl)-L-asparaginyl)amino)butyl)-(4aS,8aS)-isoquinoline-3(S) -carboxamide; saquinavir and salts HOFFMANN-LA ROCHE INC. (US) 1993-03-23 US claimed
EP-0432695-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-06-19 EP claimed