Atazanavir

Atazanavir

SCHEMBL7993264

COC(=O)NC(C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc1ccc(-c2ccccn2)cc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C

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 Atazanavir. 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
UGT1A1 P22309 3/20 1.00
MLNR O43193 1/20 1.00
NR1I2 O75469 1/20 1.00
SLCO2B1 O94956 1/20 1.00
ABCB11 O95342 1/20 1.00
ABCB1 P08183 1/20 1.00
CCKAR P32238 1/20 1.00
OPRK1 P41145 1/20 1.00
GHSR Q92847 1/20 1.00
SLCO1B3 Q9NPD5 1/20 1.00
ABCG2 Q9UNQ0 1/20 1.00
SLCO1B1 Q9Y6L6 1/20 1.00
KCNH2 Q12809 1/20 0.72
CTSD P07339 4/20 0.57
CYP3A4 P08684 3/20 0.57
CTSE P14091 1/20 0.41
PGC P20142 1/20 0.41
PSEN1 P49768 8/20 0.40
PSEN2 P49810 8/20 0.40
APH1B Q8WW43 8/20 0.40

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
Atazanavir SCHEMBL41697 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL9975220 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL825777 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL1559640 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL1396072 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL20629941 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL21565117 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL20629937 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL22847477 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11
Atazanavir SCHEMBL41696 1.00 UGT1A1 (1.00) UGT1A1MLNRNR1I2SLCO2B1ABCB11

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230288402-A1 MOLECULES TARGETING RIBOSOMAL PROTEIN RPL35/UL29 FOR USE IN THE TREATMENT OF DISEASES, IN PARTICULAR EPIDERMOLYSIS BULLOSA (EB) KBHB Consult GmbH (AT) 2023-09-14 US disclosed
US-20230218644-A1 COMPOUNDS FOR USE IN THE TREATMENT OF VIRAL INFECTIONS BY RESPIRATORY SYNDROME-RELATED CORONAVIRUS EWHA WOMANS UNIVERSITY (KR) 2023-07-13 US disclosed
US-20230173079-A1 Conjugate Molecules DIVERSE BIOTECH, INC. (US) 2023-06-08 US disclosed
US-20230148179-A1 SMALL MOLECULE INHIBITORS OF SARS-CoV-2 VIRAL REPLICATION AND USES THEREOF NATIONAL INSTITUTES OF HEALTH 2023-05-11 US disclosed
US-20230027055-A1 HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2023-01-26 US disclosed
US-11352329-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2022-06-07 US disclosed
US-11318119-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2022-05-03 US disclosed
US-11311609-B2 Regulating chimeric antigen receptors DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-04-26 US disclosed
US-11078208-B1 HIV inhibitor compounds GILEAD SCIENCES, INC. (US) 2021-08-03 US disclosed
US-11052087-B2 Anti-HIV compounds GILEAD SCIENCES, INC. (US) 2021-07-06 US disclosed
US-20190210978-A1 HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2019-07-11 US disclosed
US-10294234-B2 HIV inhibitor compounds GILEAD SCIENCES, INC. (US) 2019-05-21 US disclosed
US-20190125875-A1 ATAZANAVIR SULFATE FORMULATIONS WITH IMPROVED Ph EFFECT BRISTOL MYERS SQUIBB CO (US) 2019-05-02 US disclosed
EP-2956439-B1 PROCESS FOR PREPARING ATAZANAVIR SULPHATE CIPLA LTD (IN) 2019-01-09 EP disclosed
US-20180071270-A1 TABLETED COMPOSITIONS CONTAINING ATAZANAVIR BRISTOL MYERS SQUIBB CO (US) 2018-03-15 US disclosed
US-9890121-B2 Process for preparing atazanavir sulphate CIPLA LIMITED (IN) 2018-02-13 US disclosed
US-20180021436-A1 ATAZANAVIR SULFATE FORMULATIONS WITH IMPROVED Ph EFFECT BRISTOL MYERS SQUIBB CO (US) 2018-01-25 US disclosed
US-20090270499-A1 Process for Synthesizing Atazanavir OXYRANE (UK) LIMITED (UK) 2009-10-29 US disclosed
US-20090270499-A1 Process for Synthesizing Atazanavir OXYRANE (UK) LIMITED (UK) 2009-10-29 US disclosed
WO-2009130534-A1 PROCESS FOR SYNTHESIZING ATAZANAVIR OXYRANE (PTY) LTD. (ZA) 2009-10-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230027055-A1 HIV INHIBITOR COMPOUNDS NFATC1, SAMHD1, CCR5 UGT1A1 1691/4885MLNR 4335/4885NR1I2 3135/4885
US-11052087-B2 Anti-HIV compounds CCR5, CD4, NFATC1 UGT1A1 624/4885MLNR 4126/4885NR1I2 3064/4885
US-20180071270-A1 TABLETED COMPOSITIONS CONTAINING ATAZANAVIR ACIN1, ATAD5, PGA5 UGT1A1 970/4885MLNR 1210/4885NR1I2 3899/4885
US-11352329-B2 HIV protease inhibitors PRSS1, SERPINB1, FURIN UGT1A1 1587/4885MLNR 4096/4885NR1I2 3200/4885
US-20190125875-A1 ATAZANAVIR SULFATE FORMULATIONS WITH IMPROVED Ph EFFECT ACIN1, SAMHD1, ARSA UGT1A1 2092/4885MLNR 2550/4885NR1I2 3993/4885
US-20190210978-A1 HIV PROTEASE INHIBITORS PRSS1, SERPINB1, HPN UGT1A1 2264/4885MLNR 4024/4885NR1I2 3134/4885
US-11078208-B1 HIV inhibitor compounds NFATC1, SAMHD1, CCR5 UGT1A1 1691/4885MLNR 4335/4885NR1I2 3135/4885
US-20230218644-A1 COMPOUNDS FOR USE IN THE TREATMENT OF VIRAL INFECTIONS BY RESPIRATORY SYNDROME-RELATED CORONAVIRUS ACE2, ACE, TMPRSS2 UGT1A1 4630/4885MLNR 1389/4885NR1I2 1985/4885
US-11318119-B2 HIV protease inhibitors ACE, PRSS1, TMPRSS2 UGT1A1 3260/4885MLNR 4179/4885NR1I2 4409/4885
US-11311609-B2 Regulating chimeric antigen receptors NFATC1, TNFRSF9, IL2RA UGT1A1 4517/4885MLNR 1970/4885NR1I2 3465/4885
US-20230148179-A1 SMALL MOLECULE INHIBITORS OF SARS-CoV-2 VIRAL REPLICATION AND USES THEREOF ACE2, ACE, SARS1 UGT1A1 2487/4885MLNR 2651/4885NR1I2 862/4885
US-20230173079-A1 Conjugate Molecules CNR2, CNR1, MAG UGT1A1 345/4885MLNR 461/4885NR1I2 2269/4885
US-20180021436-A1 ATAZANAVIR SULFATE FORMULATIONS WITH IMPROVED Ph EFFECT ACIN1, SAMHD1, ARSA UGT1A1 2092/4885MLNR 2550/4885NR1I2 3993/4885
US-10294234-B2 HIV inhibitor compounds NFATC1, SAMHD1, CCR5 UGT1A1 1691/4885MLNR 4335/4885NR1I2 3135/4885
US-20090270499-A1 Process for Synthesizing Atazanavir SAMHD1, TYMS, COASY UGT1A1 309/4885MLNR 3692/4885NR1I2 3219/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.