Leucine

Leucine

SCHEMBL16651963

CC(C)C[C@H](N)C(=O)[O-].[Cl-].[Na+].[Na+]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.56
SLC1A3 P43003 3/20 0.43
SLC1A2 P43004 3/20 0.43
CA2 P00918 1/20 0.42
ANPEP P15144 6/20 0.41
RNPEP Q9H4A4 2/20 0.41
DNPEP Q9ULA0 1/20 0.41
CA1 P00915 2/20 0.39
LAP3 P28838 4/20 0.38
ERAP1 Q9NZ08 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
AAK1 Q2M2I8 1/20 0.37
SLC1A1 P43005 2/20 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
Leucine SCHEMBL2286761 0.98 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL9581376 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL3285972 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL30109857 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL3362640 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL7781917 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL10619258 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL8802761 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL9303138 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP
Leucine SCHEMBL9453845 0.93 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2CA2ANPEP

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-10105500-B2 Dry powder inhaler (DPI) designs for producing aerosols with high fine particle fractions VIRGINIA COMMONWEALTH UNIVERSITY (US) 2018-10-23 US disclosed
US-20150107589-A1 DRY POWDER INHALER (DPI) DESIGNS FOR PRODUCING AEROSOLS WITH HIGH FINE PARTICLE FRACTIONS VIRGINIA COMMONWEALTH UNIVERSITY 2015-04-23 US disclosed