SCHEMBL4632980

SCHEMBL4632980

NC(C(=O)O)C(N)C(=O)O.[NaH].[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.59
SLC1A3 P43003 5/20 0.48
SLC1A2 P43004 5/20 0.48
SLC1A1 P43005 5/20 0.48
USP2 O75604 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43
PTGS1 P23219 1/20 0.40
SLC7A11 Q9UPY5 1/20 0.40
GSR P00390 1/20 0.39
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
GRM2 Q14416 1/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL1007447 0.96 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL29957453 0.96 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL25933046 0.96 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL600021 0.96 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL468084 0.96 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1USP2
Hydrochloric Acid SCHEMBL11095114 0.92 SLC7A5 (0.59) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL4633860 0.92 SLC7A5 (0.59) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL28153656 0.85 SLC7A5 (0.53) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL3930054 0.82 SLC7A5 (0.50) SLC7A5SLC1A3SLC1A2SLC1A1USP2
SCHEMBL5326967 0.80

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-9201075-B2 Colorimetric and fluorometric determination of homocysteine and cysteine BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2015-12-01 US disclosed
US-20080261315-A1 High speed, accurate, direct assay of human blood NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-23 US disclosed
EP-1745278-A4 COLORIMETRIC AND FLUOROMETRIC DETERMINATION OF HOMOCYSTEINE AND CYSTEINE UNIV LOUISIANA STATE (US) 2008-05-28 EP disclosed
EP-1745278-A2 COLORIMETRIC AND FLUOROMETRIC DETERMINATION OF HOMOCYSTEINE AND CYSTEINE THE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2007-01-24 EP disclosed
WO-2005110109-A2 COLORIMETRIC AND FLUOROMETRIC DETERMINATION OF HOMOCYSTEINE AND CYSTEINE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2005-11-24 WO disclosed