Leucovorin

Leucovorin

SCHEMBL1259919

Nc1nc2c(c(=O)[nH]1)N(C=O)C(CNC1=CCC(C(=O)N[C@@H](CCC(=O)O)C(=O)O)CC1)=CN2.Nc1nc2c(c(=O)[nH]1)N(C=O)C(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.71
▸ LMNA P02545 1/20 0.58
▸ MTHFD1 P11586 2/20 0.53
▸ SOST Q9BQB4 1/20 0.51
▸ MTHFD2 P13995 2/20 0.46
▸ FPGS Q05932 2/20 0.46
▸ ATIC P31939 3/20 0.44
▸ TYMS P04818 1/20 0.43
▸ GART P22102 5/20 0.43

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
SCHEMBL5064786 0.87 DHFR (0.46) DHFRMTHFD1SOSTMTHFD2ATIC
Leucovorin SCHEMBL29379632 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Folinic Acid SCHEMBL21498299 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL29385578 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL4575698 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL3031362 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL36113 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Folinic Acid SCHEMBL29616563 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL258832 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2
Leucovorin SCHEMBL159828 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTMTHFD2

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-20110177958-A1 METHODS AND MATERIALS FOR IDENTIFYING POLYMORPHIC VARIANTS, DIAGNOSING SUSCEPTIBILITIES, AND TREATING DISEASE THE UNITED STATES OF AMERICA, AS REPRESENTED BY SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-07-21 — — US disclosed
US-7879551-B2 Using presence of variation in methylenetetrahydrofolate dehydrogenase as evaluative tool in diagnosis/prognosis of pregnancy-related disorders THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-02-01 — — US disclosed
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