Argatroban

Argatroban

SCHEMBL1145427

C[C@@H]1CCN(C(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c2cccc3c2NC[C@H](C)C3)[C@@H](C(=O)O)C1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

F2

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F2 known ✓ P00734 7/20 0.83
▸ PRSS1 P07477 2/20 0.78
▸ F10 P00742 2/20 0.78
▸ LMNA P02545 1/20 0.78
▸ PLAT P00750 1/20 0.78
▸ PRSS2 P07478 1/20 0.78
▸ PRSS3 P35030 1/20 0.78

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
Argatroban SCHEMBL4374 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL6852675 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL4308143 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL4933701 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL1145308 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL1817517 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL3175687 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL29572887 1.00 F2 (0.83) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL23356536 0.99 F2 (0.82) F2PRSS1F10LMNAPLAT
Argatroban SCHEMBL3135842 0.99 F2 (0.82) F2PRSS1F10LMNAPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115554245-A Argatroban injection liposome and preparation method thereof 山东新时代药业有限公司 2023-01-03 — — CN disclosed
EP-2285799-B1 METHOD FOR PREPARING ARGATROBAN MONOHYDRATE LUNDBECK PHARMACEUTICALS ITALY S P A (IT) 2015-02-25 — — EP disclosed
EP-2687522-A1 A polymorph of argatroban monohydrate and a process for its synthesis Lundbeck Pharmaceuticals Italy S.P.A. (IT) 2014-01-22 — — EP disclosed
US-8378106-B2 Method for preparing argatroban monohydrate and a process for its synthesis LUNDBECK PHARMACEUTICALS ITALY S.P.A. (IT) 2013-02-19 — — US disclosed
US-20120202850-A1 METHOD FOR TREATING THROMBOSIS AND INHIBITING PLATELET AGGREGATION WITH 21-(S)-ARGATROBAN TIANJIN WEIJIE TECHNOLOGY CO., LTD. (CN) 2012-08-09 — — US disclosed
US-20110028726-A1 METHOD FOR PREPARING ARGATROBAN MONOHYDRATE AND A PROCESS FOR ITS SYNTHESIS LUNDBECK PHARMACEUTICALS ITALY S.P.A. (IT) 2011-02-03 — — US disclosed
US-20100016356-A1 METHOD FOR TREATING THROMBOSIS AND INHIBITING PLATELET AGGREGATION WITH 21-(S)-ARGATROBAN TIANJIN WEIJIE TECHNOLOGY CO., LTD. (CN) 2010-01-21 — — 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 (3 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-20120202850-A1 METHOD FOR TREATING THROMBOSIS AND INHIBITING PLATELET AGGREGATION WITH 21-(S)-ARGATROBAN F2, PIGS, PLAT F2 1/4885PRSS1 144/4885F10 11/4885
US-20100016356-A1 METHOD FOR TREATING THROMBOSIS AND INHIBITING PLATELET AGGREGATION WITH 21-(S)-ARGATROBAN F2, PIGS, SERPINC1 F2 1/4885PRSS1 157/4885F10 9/4885
US-20110028726-A1 METHOD FOR PREPARING ARGATROBAN MONOHYDRATE AND A PROCESS FOR ITS SYNTHESIS ASS1, PRMT7, PRMT3 F2 293/4885PRSS1 1872/4885F10 2500/4885

“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.

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