Valine

Valine

SCHEMBL7704095

CC(C)[C@H](N)C(=O)O.NC(=O)Cl

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.79
SLC1A3 P43003 3/20 0.41
SLC1A2 P43004 3/20 0.41
SLC1A1 P43005 2/20 0.41
TP53 P04637 1/20 0.36
DPP4 P27487 3/20 0.35
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
ACHE P22303 1/20 0.35
LAP3 P28838 1/20 0.35
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
USP2 O75604 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
BHMT Q93088 1/20 0.32
BHMT2 Q9H2M3 1/20 0.32
ENPEP Q07075 1/20 0.32

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
Valine SCHEMBL9399607 0.92 SLC7A5 (0.83) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL4261471 0.92 SLC7A5 (0.83) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL7207898 0.90 SLC7A5 (0.79) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL19548431 0.90 SLC7A5 (0.79) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL756026 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL15602719 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL2213629 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL482773 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL935768 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL27571970 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901488-B1 2,4-DIAMINOPYRIMIDINE DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2002-11-06 EP disclosed
EP-0901488-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-03-17 EP disclosed
US-5866583-A Substituted 2,4-diaminopyrimidines HOFFMANN-LA ROCHE INC. (US) 1999-02-02 US disclosed
WO-1997043277-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-11-20 WO disclosed
US-5246912-A Liquid oil in water- or microemulsions BEROL NOBEL (SUISSE) S.A. (CH) 1993-09-21 US disclosed
US-4767448-A STABILIZED MIXTURE OF PHENMEDIPHAM AND DESMEDIPHAM WITH SURFACTANT, MINERAL AND VEGETABLE OILS AND CARBOXYLIC ESTER OF AN ALCOHOL KEMISK VAERK KOGE A/S (DK) 1988-08-30 US disclosed
US-4748265-A Process for the preparation of herbicidally active phenyl carbamates KEMISK VAERK KOGE A/S (DK) 1988-05-31 US disclosed
EP-0242888-A2 Stabilized liquid herbicidal composition and process for its preparation Hoechst Schering AgrEvo GmbH (DE) 1987-10-28 EP disclosed
EP-0142670-A2 A process for the preparation of known herbicidally active phenyl carbamates BEROL NOBEL (SUISSE) S.A. (CH) 1985-05-29 EP disclosed
WO-1985001286-A1 A PROCESS FOR THE PREPARATION OF HERBICIDALLY ACTIVE PHENYL CARBAMATES AND HERBICIDAL COMPOSITIONS CONTAINING THE SAME KEMISK VA^ERK KO^/GE A/S (DK) 1985-03-28 WO disclosed
EP-0037482-B1 3,4,5,6-TETRAHYDRO-1,2,4,6-THIATRIAZINE(3,5)DIONE-1,1-DIOXIDES, THEIR PREPARATION, HERBICIDES CONTAINING THEM, PROCESS FOR COMBATING GROWTH OF UNWANTED VEGETATION AND PROCESS FOR THE PREPARATION OF HERBICIDES BASF Aktiengesellschaft (DE) 1985-03-13 EP disclosed
EP-0037482-A2 3,4,5,6-Tetrahydro-1,2,4,6-thiatriazine(3,5)dione-1,1-dioxides, their preparation, herbicides containing them, process for combating growth of unwanted vegetation and process for the preparation of herbicides BASF Aktiengesellschaft (DE) 1981-10-14 EP disclosed