Perchlorate

Perchlorate

SCHEMBL11536227

[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2cc(-c3ccccc3)[n+](-c3ccccc3)c(-c3ccccc3)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 1.00
RAB9A P51151 10/20 1.00
HTT P42858 4/20 1.00
NTSR1 P30989 3/20 1.00
MAPK1 P28482 2/20 1.00
NPSR1 Q6W5P4 2/20 1.00
KDM4E B2RXH2 2/20 1.00
UHRF1 Q96T88 1/20 1.00
NR2F2 P24468 1/20 0.77
RAD52 P43351 1/20 0.77
RCE1 Q9Y256 1/20 0.77
KMT2A Q03164 4/20 0.71
MEN1 O00255 3/20 0.71
MAPT P10636 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
LMNA P02545 1/20 0.71
NPY1R P25929 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
CA2 P00918 3/20 0.69
CRHBP P24387 1/20 0.69

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
SCHEMBL11533950 0.92 NPC1 (0.84) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL805082 0.87 NPC1 (0.77) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL1501554 0.86 NPC1 (0.75) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL28969696 0.85 NPC1 (0.73) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL11537385 0.85 NPC1 (0.73) NPC1RAB9AHTTNTSR1MAPK1
Perchlorate SCHEMBL9508583 0.83 RAB9A (0.70) NPC1RAB9AHTTNTSR1MAPK1
Water SCHEMBL29507345 0.82 NPC1 (0.70) NPC1RAB9AHTTNTSR1MAPK1
Acetic Acid SCHEMBL11532250 0.82 NPC1 (0.69) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL158977 0.79 NPC1 (0.66) NPC1RAB9AHTTNTSR1MAPK1
SCHEMBL4250857 0.78 RAB9A (0.87) NPC1RAB9AHTTNTSR1MAPK1

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
US-4150233-A Water-soluble tetraphenylpyridinium salt for use as an analytical reagents CHADWICK THOMAS C 1979-04-17 US disclosed