Isoleucine

Isoleucine

SCHEMBL28297578

CCC(C)C(N)C(=O)O.ClCc1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.47
SLC1A2 P43004 4/20 0.47
SLC1A1 P43005 4/20 0.47
DPP8 Q6V1X1 2/20 0.47
DPP9 Q86TI2 2/20 0.47
DPP7 Q9UHL4 2/20 0.47
DPP4 P27487 1/20 0.47
ACE P12821 2/20 0.46
CYP2D6 P10635 2/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
ALPI P09923 1/20 0.43
PKM P14618 1/20 0.43
PTGS1 P23219 1/20 0.43
XIAP P98170 1/20 0.43
SLC7A5 Q01650 1/20 0.43
MME P08473 1/20 0.43

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
(Chloromethyl)Benzene SCHEMBL27760750 0.83 ALPI (0.52) SLC1A3SLC1A2SLC1A1CYP2D6MEN1
D-Phenylalanine SCHEMBL1537166 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
D-Phenylalanine SCHEMBL1537167 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
Dl-Phenylalanine SCHEMBL528153 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
D-Phenylalanine SCHEMBL1537464 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
Phenylalanine SCHEMBL1537266 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
Phenylalanine SCHEMBL528154 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
D-Phenylalanine SCHEMBL1537463 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1ACECYP2D6
Isoleucine SCHEMBL27837499 0.82 DPP4 (0.47) SLC1A3SLC1A2SLC1A1DPP8DPP9
Isoleucine SCHEMBL28041858 0.82 DPP4 (0.50) SLC1A3SLC1A2SLC1A1DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109847455-B Composite material for filtering fine particles, preparation method and application thereof 四川大学 2021-07-06 CN claimed
CN-109847455-A A kind of composite material, preparation method and application for filtering fine particulates 四川大学 2019-06-07 CN claimed
CN-109847455-B Composite material for filtering fine particles, preparation method and application thereof 四川大学 2021-07-06 CN disclosed
CN-109847455-A A kind of composite material, preparation method and application for filtering fine particulates 四川大学 2019-06-07 CN disclosed