Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL2956990

CCCCC(O)COCCOCCO.N

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
HTT P42858 2/20 0.52
THRB P10828 1/20 0.52
MAPT P10636 1/20 0.52
USP2 O75604 2/20 0.50
CYP3A4 P08684 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.41
LPAR5 Q9H1C0 1/20 0.39
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLCO1B3 Q9NPD5 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36
PLA2G2C Q5R387 2/20 0.36

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
SCHEMBL1567818 0.98 TSHR (0.54) TSHRMEN1KMT2AHTTTHRB
SCHEMBL28533578 0.98 TSHR (0.54) TSHRMEN1KMT2AHTTTHRB
SCHEMBL28790449 0.98 TSHR (0.54) TSHRMEN1KMT2AHTTTHRB
SCHEMBL28790383 0.98 TSHR (0.54) TSHRMEN1KMT2AHTTTHRB
SCHEMBL28524372 0.98 TSHR (0.54) TSHRMEN1KMT2AHTTTHRB
SCHEMBL27973903 0.94 USP2 (0.55) TSHRMEN1KMT2AHTTTHRB
SCHEMBL1266266 0.94 USP2 (0.55) TSHRMEN1KMT2AHTTTHRB
Boric Acid SCHEMBL28425708 0.93 MEN1 (0.48) TSHRMEN1KMT2AHTTTHRB
Boric Acid SCHEMBL28517514 0.93 MEN1 (0.48) TSHRMEN1KMT2AHTTTHRB
SCHEMBL28816475 0.93 MEN1 (0.57) TSHRMEN1KMT2AHTTTHRB

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
US-7759454-B2 Process for preparing amides based on polyetheramines and (meth)acrylic acid CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2010-07-20 US disclosed
US-20060252884-A1 Process for preparing amides based on polyetheramines and (meth)acrylic acid CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-11-09 US disclosed