SCHEMBL9154302

SCHEMBL9154302

N[C@@H](Cc1cccc(P(=O)(O)O)c1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 7/20 0.59
PTGS1 P23219 2/20 0.59
ALPI P09923 1/20 0.59
PKM P14618 1/20 0.59
XIAP P98170 1/20 0.59
GRIA2 P42262 1/20 0.56
MAPK1 P28482 1/20 0.55
NOS3 P29474 2/20 0.55
NOS1 P29475 2/20 0.55
NOS2 P35228 2/20 0.55
KDM4E B2RXH2 1/20 0.51
USP2 O75604 1/20 0.51
EGFR P00533 1/20 0.51
LCK P06239 1/20 0.51
FYN P06241 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
ALOX15 P16050 1/20 0.51
HTR2A P28223 1/20 0.51
PTGS2 P35354 1/20 0.51
RECQL P46063 1/20 0.51

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
SCHEMBL9154305 1.00 SLC7A5 (0.59) SLC7A5PTGS1ALPIPKMXIAP
Hydrochloric Acid SCHEMBL9158215 0.98 SLC7A5 (0.57) SLC7A5PTGS1ALPIPKMXIAP
Hydrochloric Acid SCHEMBL9157606 0.98 SLC7A5 (0.57) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL2314258 0.83 SLC7A5 (0.77) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL6021374 0.81 MAPK1 (0.66) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL499205 0.81 MAPK1 (0.66) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL14028487 0.81 SLC7A5 (0.59) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL4898726 0.80 SLC7A5 (0.62) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL4898727 0.80 SLC7A5 (0.62) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL29588244 0.80 SLC7A5 (0.62) SLC7A5PTGS1ALPIPKMXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0318935-B1 Substituted alpha-amino acids having pharmaceutical activity WARNER LAMBERT CO (US) 1995-02-01 EP claimed
US-5175153-A Antiischemic agents or antiepileptic agents WARNER-LAMBERT COMPANY (US) 1992-12-29 US claimed
EP-0318935-A2 Substituted alpha-amino acids having pharmaceutical activity WARNER-LAMBERT COMPANY (US) 1989-06-07 EP claimed