Valine

SCHEMBL6368983

CC(C)[C@H](N)C(=O)O.CC(C)[C@H](N)C(=O)O.CC(C)[C@H](N)C(=O)O.CC(C)[C@H](N)C(=O)O.C[C@H](N)C(=O)O.C[C@H](N)C(=O)O.NCC(=O)O.NCC(=O)O.N[C@@H](CS)C(=O)[O-].N[C@@H](CS)C(=O)[O-].O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.[Cu+2]

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	SLC7A5	Q01650	1/20	0.31

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
Valine SCHEMBL3054587	0.96	SLC7A5 (0.34)	SLC7A5
Valine SCHEMBL5666087	0.91	PTGS1 (0.36)	SLC7A5
Valine SCHEMBL28189265	0.91	PTGS1 (0.36)	SLC7A5
Glutamine SCHEMBL6860246	0.91	ALOX15 (0.33)	—
Valine SCHEMBL6368984	0.90	PTGS1 (0.36)	SLC7A5
Asparagine SCHEMBL7138311	0.88	PTGS1 (0.31)	—
Valine SCHEMBL5801852	0.88	SLC7A5 (0.41)	SLC7A5
Valine SCHEMBL3048383	0.88	SLC7A5 (0.41)	SLC7A5
Valine SCHEMBL4612496	0.88	SLC7A5 (0.41)	SLC7A5
Valine SCHEMBL2189978	0.88	SLC7A5 (0.41)	SLC7A5

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
US-6962904-B1	Elastin peptide analogs and uses thereof	CONNECTIVE TISSUE IMAGINEERING (US)	2005-11-08	—	—	US	disclosed