Emtricitabine

Emtricitabine

SCHEMBL12202574

Nc1nc(=O)n([C@H]2CSC(CO)O2)cc1F

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 Emtricitabine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALB P02768 3/20 1.00
POLG P54098 2/20 0.64
LMNA P02545 3/20 0.63
CACNA1F O60840 2/20 0.63
MAPT P10636 2/20 0.63
CACNA1D Q01668 2/20 0.63
CACNA1S Q13698 2/20 0.63
CACNA1C Q13936 2/20 0.63
PDE3A Q14432 2/20 0.63
DCK P27707 7/20 0.36
DNMT1 P26358 5/20 0.36
ADRB1 P08588 1/20 0.36
DNMT3B Q9UBC3 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
Emtricitabine, (+/-)- SCHEMBL122131 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL267686 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL3230512 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL6903677 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL5427218 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL6362885 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL3722124 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL39708 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL22413085 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT
Emtricitabine SCHEMBL12662838 1.00 ALB (1.00) ALBPOLGLMNACACNA1FMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3782611-A1 ORAL FORMULATIONS OF CYTIDINE ANALOGS AND METHODS OF USE THEREOF Celgene Corporation (US) 2021-02-24 EP disclosed
EP-3782612-A1 ORAL FORMULATIONS OF CYTIDINE ANALOGS AND METHODS OF USE THEREOF Celgene Corporation (US) 2021-02-24 EP disclosed
US-8859756-B2 Stereoselective synthesis of phosphorus containing actives GILEAD PHARMASSET LLC (US) 2014-10-14 US disclosed
US-20110245484-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES PHARMASSET, INC. (US) 2011-10-06 US 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 (1 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-20110245484-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES PPA1, ENPP1, ITPA ALB 1835/4885POLG 458/4885LMNA 3477/4885

“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.