Leucine

Leucine

SCHEMBL4586599

CC(C)C[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)Oc1ccc(C[C@H](N)C(=O)O)cc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 3/20 0.56
ITGA2B P08514 3/20 0.56
THRB P10828 1/20 0.47
PTPN1 P18031 1/20 0.43
GSR P00390 1/20 0.42
SLC7A5 Q01650 4/20 0.42
ALPI P09923 1/20 0.40
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.40
XIAP P98170 1/20 0.40
LNPEP Q9UIQ6 2/20 0.40
ERAP2 Q6P179 2/20 0.40
ERAP1 Q9NZ08 1/20 0.40
MMP2 P08253 1/20 0.40
ANPEP P15144 1/20 0.39
RNPEP Q9H4A4 1/20 0.39
DNPEP Q9ULA0 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL571283 0.92 ITGB3 (0.65) ITGB3ITGA2BTHRBPTPN1GSR
Lysine SCHEMBL1921517 0.87 ITGB3 (0.60) ITGB3ITGA2BTHRBPTPN1GSR
Tyrosine SCHEMBL3485476 0.87 ITGB3 (0.60) ITGB3ITGA2BTHRBPTPN1GSR
Phenylalanine SCHEMBL1921138 0.87 ITGB3 (0.44) ITGB3ITGA2BTHRBSLC7A5ALPI
SCHEMBL829349 0.87 SLC7A5 (0.51) ITGB3ITGA2BPTPN1SLC7A5ALPI
Cysteine SCHEMBL9755060 0.86 ITGB3 (0.58) ITGB3ITGA2BTHRBPTPN1GSR
Lysine SCHEMBL4198912 0.86 ITGB3 (0.53) ITGB3ITGA2BTHRBPTPN1GSR
SCHEMBL1920941 0.85 ITGB3 (0.55) ITGB3ITGA2BTHRBPTPN1GSR
SCHEMBL10613823 0.85 NPY4R (0.47) ITGB3ITGA2BTHRBSLC7A5MMP2
Glutamic Acid SCHEMBL1696963 0.85 ITGB3 (0.57) ITGB3ITGA2BTHRBPTPN1GSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850497-A YKL-40 monoclonal antibody and preparation method and application thereof 陕西脉元生物科技有限公司 2023-03-28 CN disclosed
EP-1487395-B1 METHODS OF DIAGNOSING LIVER FIBROSIS NESTEC SA (CH) 2013-04-10 EP disclosed
EP-1487395-A4 METHODS OF DIAGNOSING LIVER FIBROSIS PROMETHEUS LAB INC (US) 2008-09-10 EP disclosed
US-20060084057-A1 Methods of diagnosing liver fibrosis PROMETHEUS LABORATORIES 2006-04-20 US disclosed
US-6986995-B2 Methods of diagnosing liver fibrosis PROMETHEUS LABORATORIES, INC. (US) 2006-01-17 US disclosed
EP-1487395-A2 METHODS OF DIAGNOSING LIVER FIBROSIS Prometheus Laboratories, Inc. (US) 2004-12-22 EP disclosed
US-20030175686-A1 Methods of diagnosing liver fibrosis PROMETHEUS LABORATORIES, INC. 2003-09-18 US disclosed
WO-2003073822-A2 METHODS OF DIAGNOSING LIVER FIBROSIS PROMETHEUS LABORATORIES, INC. (US) 2003-09-12 WO disclosed