Leucine

SCHEMBL14969488

CC(C)C[C@H](N)C(=O)O.CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	7/20	0.56

▸	NMUR1	Q9HB89	6/20	0.56

▸	SLC6A2	P23975	1/20	0.54

▸	OPRM1	P35372	1/20	0.54

▸	OPRD1	P41143	1/20	0.54

▸	OPRK1	P41145	1/20	0.54

▸	NTSR2	O95665	1/20	0.52

▸	NTSR1	P30989	1/20	0.52

▸	SORT1	Q99523	1/20	0.52

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.

Compound	similarity	top predicted	shared targets
SCHEMBL1674805	0.98	NMUR2 (0.57)	NMUR2NMUR1SLC6A2OPRM1OPRD1
SCHEMBL1674802	0.98	NMUR2 (0.57)	NMUR2NMUR1SLC6A2OPRM1OPRD1
SCHEMBL28915426	0.96	NMUR2 (0.58)	NMUR2NMUR1SLC6A2OPRM1OPRD1
SCHEMBL28915423	0.96	NMUR2 (0.58)	NMUR2NMUR1SLC6A2OPRM1OPRD1
SCHEMBL22400261	0.93	OPRM1 (0.55)	SLC6A2OPRM1OPRD1OPRK1NTSR2
SCHEMBL1674810	0.93	OPRM1 (0.55)	SLC6A2OPRM1OPRD1OPRK1NTSR2
SCHEMBL1674814	0.93	OPRM1 (0.55)	SLC6A2OPRM1OPRD1OPRK1NTSR2
SCHEMBL31377408	0.93	SLC6A2 (0.57)	SLC6A2OPRM1OPRD1OPRK1
SCHEMBL30853506	0.90	NTSR2 (0.63)	SLC6A2NTSR2NTSR1SORT1
SCHEMBL29679668	0.87	SLC6A2 (0.61)	NMUR2NMUR1SLC6A2OPRM1OPRD1

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2013072332-A1	METHODS OF USING ANTAGONISTS OF BITTER TASTE RECEPTORS	GIVAUDAN SA (CH)	2013-05-23	—	—	WO	disclosed