Aspartic Acid

Aspartic Acid

SCHEMBL165913

CN1CCc2ccc(Cl)cc2CC1.N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SSTR1SSTR2SSTR3SSTR5

The experimentally established mechanism targets of Aspartic Acid. 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
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 1/20 0.44
MCHR1 Q99705 2/20 0.43
NOTUM Q6P988 2/20 0.41
HDAC8 Q9BY41 1/20 0.40
ACACB O00763 1/20 0.39
GRIK1 P39086 1/20 0.39
DRD2 P14416 4/20 0.39
DRD3 P35462 4/20 0.39
DRD1 P21728 3/20 0.39
DRD5 P21918 3/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
DRD4 P21917 2/20 0.39
MEN1 O00255 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
Glutamic Acid SCHEMBL161108 0.88 MCHR1 (0.46) SLC1A3SLC1A2SLC1A1HTR2AHTR2C
SCHEMBL160943 0.77 HTR2A (0.55) HTR2AHTR2CHTR2BNOTUMDRD2
SCHEMBL6883015 0.72 MAOA (0.59) HTR2AHTR2CHTR2BDRD2DRD3
Aspartic Acid SCHEMBL162171 0.72 DPP8 (0.45) HTR2AHTR2BHDAC8GRIK1DRD2
Nitric Acid SCHEMBL165780 0.72 HTR2A (0.50) HTR2AHTR2CHTR2BMCHR1NOTUM
Lorcaserin SCHEMBL15389882 0.72 HTR2A (0.64) SLC1A3SLC1A2SLC1A1HTR2AHTR2C
Lorcaserin SCHEMBL175421 0.72 HTR2A (0.64) SLC1A3SLC1A2SLC1A1HTR2AHTR2C
Lorcaserin SCHEMBL174127 0.72 HTR2A (0.64) SLC1A3SLC1A2SLC1A1HTR2AHTR2C
SCHEMBL29991420 0.70 MAOA (0.55) HTR2AHTR2CHTR2BNOTUMDRD2
SCHEMBL2625798 0.70 MAOA (0.55) HTR2AHTR2CHTR2BNOTUMDRD2

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-2611449-A1 ADMINISTRATION OF LORCASERIN TO INDIVIDUALS WITH RENAL IMPAIRMENT Arena Pharmaceuticals, Inc. (US) 2013-07-10 EP disclosed
WO-2012030939-A1 ADMINISTRATION OF LORCASERIN TO INDIVIDUALS WITH RENAL IMPAIRMENT ARENA PHARMACEUTICALS, INC. (US) 2012-03-08 WO disclosed