SCHEMBL31169496

SCHEMBL31169496

N[C@@H](CC(=O)O)C(=O)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC22A6 Q4U2R8 1/20 0.36
▸ GABRR1 P24046 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ GRIK1 P39086 2/20 0.34
▸ GRIK2 Q13002 2/20 0.34
▸ GRM1 Q13255 2/20 0.34
▸ GRM2 Q14416 2/20 0.34
▸ GRM8 O00222 1/20 0.34
▸ GRM6 O15303 1/20 0.34
▸ GRIN2D O15399 1/20 0.34
▸ GRIN3B O60391 1/20 0.34
▸ GSR P00390 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ GRM5 P41594 1/20 0.34
▸ GRIA1 P42261 1/20 0.34
▸ GRIA2 P42262 1/20 0.34
▸ GRIA3 P42263 1/20 0.34
▸ SLC1A3 P43003 1/20 0.34
▸ SLC1A2 P43004 1/20 0.34

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
Aspartic Acid SCHEMBL8888023 0.78 GRIK1 (0.48) TDP1GRIK1GRIK2GRM1GRM2
Aspartic Acid SCHEMBL8888026 0.78 GRIK1 (0.48) TDP1GRIK1GRIK2GRM1GRM2
Aspartic Acid SCHEMBL5868261 0.74 PMP22 (0.50) GRIK1GRIK2GRM1GRM2GRM8
Aspartic Acid SCHEMBL5868317 0.74 PMP22 (0.50) GRIK1GRIK2GRM1GRM2GRM8
Aspartic Acid SCHEMBL28252064 0.74 GRIK1 (0.45) GRIK1GRIK2GRM1GRM2GRM8
SCHEMBL1072994 0.74 — —
SCHEMBL6442112 0.74 — —
SCHEMBL333107 0.74 — —
SCHEMBL2036153 0.73 SLC22A6 (0.36) SLC22A6LMNAPMP22
SCHEMBL27324362 0.73 PTGS1 (0.50) SLC22A6PMP22PTGS1SLC7A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119034812-A Catalyst composition, method for selectively hydrogenating conjugated diene latex, hydrogenated conjugated diene latex and application thereof 山东京博中聚新材料有限公司 2024-11-29 — — CN disclosed
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