Leucine

Leucine

SCHEMBL6139261

CC(C)C[C@H](N)C(=O)O.C[C@H](N)C(=O)Oc1ccccc1.NCC(=O)O.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
REN P00797 1/20 0.35
SLC7A5 Q01650 1/20 0.35
ANPEP P15144 2/20 0.34
RNPEP Q9H4A4 1/20 0.34
DNPEP Q9ULA0 1/20 0.34
DPP4 P27487 2/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
CTSC P53634 1/20 0.33
GPR88 Q9GZN0 1/20 0.33

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
Proline SCHEMBL7423648 0.87 DPP4 (0.41) GHSRSLC6A2SLC6A4SLC6A3ANPEP
Leucine SCHEMBL6139042 0.86 SLC7A5 (0.39) GHSRSLC6A2SLC6A4SLC6A3REN
Leucine SCHEMBL6534720 0.84 SLC7A5 (0.46) RENSLC7A5DPP4DPP8
Leucine SCHEMBL7110075 0.84 SLC7A5 (0.46) RENSLC7A5DPP4DPP8
Leucine SCHEMBL28334400 0.84 SLC7A5 (0.46) RENSLC7A5DPP4DPP8
Leucine SCHEMBL23091356 0.84 SLC7A5 (0.49) RENSLC7A5DPP4DPP8
Leucine SCHEMBL5889661 0.84 SLC7A5 (0.49) RENSLC7A5DPP4DPP8
Leucine SCHEMBL3089172 0.84 SLC7A5 (0.49) RENSLC7A5DPP4DPP8
Leucine SCHEMBL21382169 0.84 SLC7A5 (0.49) RENSLC7A5DPP4DPP8
Leucine SCHEMBL4612424 0.84 SLC7A5 (0.49) RENSLC7A5DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222242-B1 CLEANING AGENTS WHICH CONTAIN SURFACTANTS AND ENZYME INHIBITORS HENKEL KGAA (DE) 2005-04-20 EP claimed