Threonine

Threonine

SCHEMBL4335256

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

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DHFRGARTPTGFRPTGIRPTGS1PTGS2TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8envmurAthyA

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.31
SLC7A5 Q01650 2/20 0.44
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
TP53 P04637 1/20 0.35
SLC1A3 P43003 3/20 0.34
SLC1A2 P43004 3/20 0.34
SLC1A1 P43005 2/20 0.34
ENPEP Q07075 2/20 0.31
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 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.

Compoundsimilaritytop predictedshared targets
Threonine SCHEMBL28749680 0.86 SLC7A5 (0.43) SLC7A5USP2SLCO1B1TP53SLC1A3
Valine SCHEMBL9234038 0.85 SLC7A5 (0.65) SLC7A5MEN1LMNAKMT2AUSP2
Valine SCHEMBL3511172 0.85 SLC7A5 (0.65) SLC7A5MEN1LMNAKMT2AUSP2
Threonine SCHEMBL563849 0.82 SLC7A5 (0.52) SLC7A5USP2SLCO1B1TP53SLC1A3
Tromethamine SCHEMBL5524829 0.82 MEN1 (0.50) SLC7A5MEN1LMNAKMT2ATP53
Tromethamine SCHEMBL28614671 0.82 TP53 (0.55) SLC7A5MEN1LMNAKMT2ATP53
Threonine SCHEMBL117301 0.82
Threonine SCHEMBL18050155 0.82 SLC7A5 (0.63) SLC7A5USP2SLCO1B1TP53SLC1A3
Threonine SCHEMBL92730 0.82
Threonine SCHEMBL6038228 0.82 SLC7A5 (0.63) SLC7A5USP2SLCO1B1TP53SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2015726-A1 COSMETIC COMPOSITION FOR STIMULATING THE SYNTHESIS OF PROTEINS OF THE BASEMENT MEMBRANE DSMIP Assets B.V. (NL) 2009-01-21 EP disclosed
WO-2007124770-A1 COSMETIC COMPOSITION FOR STIMULATING THE SYNTHESIS OF PROTEINS OF THE BASEMENT MEMBRANE DSM IP ASSETS B.V. (NL) 2007-11-08 WO disclosed