Carbon Dioxide

Carbon Dioxide

SCHEMBL28214588

Nc1cnc2ccccc2n1.O=C=O

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 3/20 0.46
ALOX15 P16050 1/20 0.46
PDE10A Q9Y233 1/20 0.45
KDM4E B2RXH2 5/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 3/20 0.44
NCF1 P14598 1/20 0.43
NOS2 P35228 1/20 0.43
BACE1 P56817 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GPR3 P46089 1/20 0.42
PDPK1 O15530 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CASP1 P29466 1/20 0.42
MAPK10 P53779 1/20 0.42

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
SCHEMBL462847 0.91 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10ALOX15PDE10A
SCHEMBL27999697 0.91 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10ALOX15PDE10A
SCHEMBL29447182 0.91 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Ammonia Solution, Strong SCHEMBL27825755 0.89 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Benzene SCHEMBL28261497 0.89 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Bromide SCHEMBL7244276 0.89 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Hydrochloric Acid SCHEMBL27776055 0.89 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Ammonia Solution, Strong SCHEMBL22288229 0.89 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Bromide SCHEMBL27818577 0.87 PDE10A (0.48) ALDH1A1HPGDHSD17B10ALOX15PDE10A
Urea SCHEMBL27360704 0.86 ALDH1A1 (0.53) ALDH1A1HPGDHSD17B10ALOX15PDE10A

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
CN-108698985-A For supplying carbon dioxide in the method for urea synthesis 蒂森克虏伯工业解决方案股份公司 2018-10-23 CN disclosed
CN-108026034-A Process for producing urea and apparatus for producing urea 东洋工程株式会社 2018-05-11 CN disclosed
CN-108026033-A Urea manufacture method and urea manufacture device 东洋工程株式会社 2018-05-11 CN disclosed