Carbon Dioxide

Carbon Dioxide

SCHEMBL27969409

CCC(C)OC(=O)O.O=C=O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
TSHR P16473 2/20 0.31
CHRM2 P08172 2/20 0.31
CHRM4 P08173 2/20 0.31
CHRM1 P11229 2/20 0.31
TBXA2R P21731 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL13195782 0.93
SCHEMBL149835 0.93
SCHEMBL25435789 0.93 MAPT (0.41) MAPTTSHRCHRM2CHRM4CHRM1
SCHEMBL13195784 0.93
Methane SCHEMBL16648887 0.90
Ethane SCHEMBL11331565 0.90 MAPT (0.40) MAPTTSHRCHRM2CHRM4CHRM1
Hydrochloric Acid SCHEMBL11861052 0.90
Ethyne SCHEMBL5537435 0.88 MAPT (0.39) MAPTTSHRCHRM2CHRM4CHRM1
SCHEMBL17780101 0.84 MAPT (0.37) MAPTTSHRCHRM2CHRM4CHRM1
Butanone SCHEMBL28528843 0.84 ALDH1A1 (0.46) MAPTTSHRCHRM2CHRM4CHRM1

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-103959511-A Electrochemical cell comprising nitrogen-containing polymer BASF SE 2014-07-30 CN disclosed