Faldaprevir

Faldaprevir

SCHEMBL25524320

C=CC1C[C@]1(NC(=O)[C@@H]1C[C@@H](Oc2cc(-c3csc(NC(=O)C(C)C)n3)nc3c(Br)c(OC)ccc23)CN1C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NS3NS4A

The experimentally established mechanism targets of Faldaprevir. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 1.00
PPP3CB P16298 1/20 1.00
ABCC1 P33527 1/20 0.55
ABCC2 Q92887 1/20 0.55
ABCG2 Q9UNQ0 1/20 0.55
ADRB3 P13945 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49
CYP3A4 P08684 1/20 0.44

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
Faldaprevir SCHEMBL7736941 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL19246297 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL15462595 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL13556415 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL222429 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL24058604 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL227410 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
Faldaprevir SCHEMBL31554839 1.00 CTSB (1.00) CTSBPPP3CBABCC1ABCC2ABCG2
SCHEMBL7736946 0.96 CTSB (0.93) CTSBPPP3CBABCC1ABCC2ABCG2
SCHEMBL11947501 0.96 CTSB (0.93) CTSBPPP3CBABCC1ABCC2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11660288-B2 Drug-controlled systems and uses thereof TRUSTEES OF BOSTON UNIVERSITY (US) 2023-05-30 US disclosed
US-20230159600-A1 REGULATED SYNTHETIC GENE EXPRESSION SYSTEMS TRUSTEES OF BOSTON UNIVERSITY (US) 2023-05-25 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 (2 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-20230159600-A1 REGULATED SYNTHETIC GENE EXPRESSION SYSTEMS SRRT, BPTF, MYCBP CTSB 4535/4885PPP3CB 2845/4885ABCC1 4123/4885
US-11660288-B2 Drug-controlled systems and uses thereof ATF4, MRPL21, SARS1 CTSB 3062/4885PPP3CB 2273/4885ABCC1 519/4885

“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.