Sugi Predict

Sugi Predict / Compounds / Cyclosporine

Cyclosporine

Cyclosporine

SCHEMBL2009060

C/C=C/C[C@@H](C)[C@@H](O)[C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C.CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)OCCCc1cccnc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPIA

The experimentally established mechanism targets of Cyclosporine. 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
▸ PPIA known ✓ P62937 5/20 0.62
▸ ABCB1 P08183 9/20 0.62
▸ PPP3CA Q08209 6/20 0.62
▸ FKBP1B P68106 3/20 0.62
▸ PPIB P23284 2/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ ABCC3 O15438 1/20 0.62
▸ GMNN O75496 1/20 0.62
▸ USP2 O75604 1/20 0.62
▸ SLCO2B1 O94956 1/20 0.62
▸ ABCB11 O95342 1/20 0.62
▸ LMNA P02545 1/20 0.62
▸ POLB P06746 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ MAPT P10636 1/20 0.62
▸ RARB P10826 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ CYP3A5 P20815 1/20 0.62
▸ TACR2 P21452 1/20 0.62

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
Cyclosporine SCHEMBL4464657 0.81 ABCB1 (0.89) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL24239446 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL24239035 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL22123717 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL23192319 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL25083206 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL24224445 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
SCHEMBL23110210 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
Cyclosporine SCHEMBL24239036 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB
SCHEMBL23382247 0.79 ABCB1 (1.00) ABCB1PPP3CAPPIAFKBP1BPPIB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120201755-A1 SENSOR SYSTEM ROZAKIS GEORGE (US) 2012-08-09 — — US disclosed
US-7964390-B2 Sensor system CASE WESTERN RESERVE UNIVERSITY (US) 2011-06-21 — — US disclosed
WO-2005074612-A9 SENSOR SYSTEM UNIV CASE WESTERN RESERVE (US) 2006-04-20 — — WO disclosed
US-20050221276-A1 Sensor system CASE WESTERN RESERVE UNIVERSITY (US) 2005-10-06 — — US disclosed
WO-2005074612-A2 SENSOR SYSTEM CASE WESTERN RESERVE UNIVERSITY (US) 2005-08-18 — — 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 (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-20120201755-A1 SENSOR SYSTEM CA13, CA12, CA14 PPIA 623/4885ABCB1 1599/4885PPP3CA 2120/4885

“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.