Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL27464133

CCCCOC(=O)C(C)=CC(C)C(=O)OC.N

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
ATM Q13315 1/20 0.41
TSHR P16473 4/20 0.40
ZDHHC7 Q9NXF8 1/20 0.39
HPGD P15428 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MAPT P10636 2/20 0.37
HSD17B10 Q99714 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
FAAH O00519 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ABCB1 P08183 1/20 0.35
EPHX1 P07099 1/20 0.34
LMNA P02545 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
SCHEMBL7087958 0.82 ALDH1A1 (0.50) ALDH1A1ATMTSHRHPGDMAPT
SCHEMBL28101258 0.80 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDMAPT
SCHEMBL1293247 0.79 ALDH1A1 (0.47) ALDH1A1ATMTSHRHPGDMAPT
SCHEMBL21837319 0.76 TSHR (0.49) ALDH1A1ATMTSHRZDHHC7CA1
SCHEMBL27615445 0.76 TSHR (0.56) ALDH1A1TSHRHCAR2NPSR1FAAH
SCHEMBL23456804 0.75 TSHR (0.51) ALDH1A1TSHRZDHHC7HCAR2NPSR1
SCHEMBL11562931 0.75 TSHR (0.51) ALDH1A1TSHRZDHHC7HCAR2NPSR1
SCHEMBL28124145 0.75 TSHR (0.51) ALDH1A1TSHRZDHHC7HCAR2NPSR1
SCHEMBL28053398 0.75 ALDH1A1 (0.43) ALDH1A1ATMTSHRHPGDMAPT
SCHEMBL29256090 0.75 TSHR (0.51) ALDH1A1TSHRZDHHC7HCAR2NPSR1

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-1137923-C Silicon-containing block-copolymer ������ҩ��ҵ��ʽ���� 2004-02-11 CN disclosed
CN-1157834-A Silicon-containing block-copolymer WAKO PURE CHEM IND LTD (JP) 1997-08-27 CN disclosed