Valine

Valine

SCHEMBL4409191

CC(C)[C@H](N)C(=O)O.C[C@@H](OC(=O)[C@@H](N)CO)[C@H](N)C(=O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.52
SLC1A1 P43005 3/20 0.35
SLC1A3 P43003 3/20 0.35
SLC1A2 P43004 3/20 0.35
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
CASR P41180 1/20 0.32
SLC15A1 P46059 1/20 0.31
KIF11 P52732 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL1537267 0.95 SLC7A5 (0.41) SLC7A5SLC1A1SLC1A3SLC1A2USP2
SCHEMBL135879 0.95 SLC7A5 (0.41) SLC7A5SLC1A1SLC1A3SLC1A2USP2
Serine SCHEMBL10612187 0.88 SLC7A5 (0.45) SLC7A5SLC1A1SLC1A3SLC1A2USP2
SCHEMBL7730688 0.87 SLC7A5 (0.35) SLC7A5SLC1A1SLC1A3SLC1A2USP2
SCHEMBL4409197 0.83 SLC7A5 (0.33) SLC7A5
SCHEMBL1925209 0.81 SLC7A5 (0.58) SLC7A5SLC1A1SLC1A3SLC1A2USP2
SCHEMBL5704260 0.80 NOS3 (0.36) SLC7A5SLC1A1SLC1A3SLC1A2USP2
Valine SCHEMBL723256 0.79 SLC7A5 (0.68) SLC7A5SLC1A1SLC1A3SLC1A2USP2
Valine SCHEMBL723255 0.79 SLC7A5 (0.68) SLC7A5SLC1A1SLC1A3SLC1A2USP2
Valine SCHEMBL2323247 0.79 SLC7A5 (0.68) SLC7A5SLC1A1SLC1A3SLC1A2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042601-A1 Novel variant EGIII-like cellulase compositions Genencor International, Inc. (US) 2009-04-01 EP disclosed
EP-1305431-A2 MUTANT TRICHODERMA REESEI EGIII CELLULASES, DNA ENCODING SUCH EGIII COMPOSITIONS AND METHODS FOR OBTAINING SAME GENENCOR INTERNATIONAL, INC. (US) 2003-05-02 EP disclosed
WO-2002012464-A2 MUTANT TRICHODERMA REESEI EGIII CELLULASES DNA ENCODING SUCH EGIII COMPOSITIONS AND METHODS FOR OBTAINING SAME GENENCOR INTERNATIONAL, INC. (US) 2002-02-14 WO disclosed