Glycerin

Glycerin

SCHEMBL28051395

CNc1ccccc1N.OCC(O)CO

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.39
HDAC1 Q13547 4/20 0.39
HDAC2 Q92769 4/20 0.39
NCOR2 Q9Y618 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
KDM4E B2RXH2 6/20 0.38
MAPT P10636 5/20 0.38
GAA P10253 3/20 0.38
CYP1A2 P05177 3/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38

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
SCHEMBL29386059 0.82
SCHEMBL157785 0.82
Hydrochloric Acid SCHEMBL159325 0.80 MAPT (0.50) HDAC3HDAC1HDAC2NCOR2HDAC10
SCHEMBL21620393 0.80 MAPT (0.56) HDAC3HDAC1HDAC2NCOR2HDAC10
Hydrochloric Acid SCHEMBL159326 0.80 MAPT (0.50) HDAC3HDAC1HDAC2NCOR2HDAC10
SCHEMBL29088264 0.80 KDM4E (0.50) HDAC3HDAC1HDAC2NCOR2HDAC10
Glycerin SCHEMBL9706702 0.80 CYP3A4 (0.53) KDM4EMAPTGAACYP1A2ALDH1A1
Phosphoric Acid SCHEMBL3807395 0.75 HDAC3 (0.48) HDAC3HDAC1HDAC2NCOR2HDAC10
Sulfuric Acid SCHEMBL5843676 0.75 HDAC3 (0.44) HDAC3HDAC1HDAC2NCOR2HDAC10
Aniline SCHEMBL22169237 0.74 MAPT (0.52) HDAC3HDAC1HDAC2NCOR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105315450-B The preparation method of full-water type polyurethane polyether polyalcohol 山东诺威新材料有限公司 2017-07-14 CN disclosed
CN-105315450-A Preparation method of polyether polyol used for total-moisture rigid polyurethane foam SHANDONG INOV NEW MATERIAL CO LTD 2016-02-10 CN disclosed