Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL9013083

CCCCC(Cl)CCl.N.N

nearest known ligand 0.38

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
TDP1 Q9NUW8 3/20 0.38
DNM1 Q05193 2/20 0.38
ALDH1A1 P00352 4/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.32
FDPS P14324 1/20 0.32
LMNA P02545 1/20 0.32
CA2 P00918 2/20 0.31
MAPK1 P28482 1/20 0.31
OPRM1 P35372 1/20 0.31
SLC22A1 O15245 2/20 0.30
SLC22A2 O15244 1/20 0.30
CA1 P00915 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
SCHEMBL5404425 0.97
SCHEMBL2479083 0.97
Chloroform SCHEMBL2961248 0.94 TSHR (0.38) TSHRTDP1DNM1ALDH1A1TP53
SCHEMBL27987813 0.90 TSHR (0.35) TSHRTDP1DNM1ALDH1A1TP53
SCHEMBL4898877 0.89
SCHEMBL2369634 0.86 TSHR (0.46) TSHRDNM1ALDH1A1FDPSLMNA
SCHEMBL420467 0.86 TSHR (0.46) TSHRDNM1ALDH1A1FDPSLMNA
SCHEMBL4896810 0.86 TSHR (0.46) TSHRDNM1ALDH1A1FDPSLMNA
SCHEMBL11402880 0.86 TSHR (0.46) TSHRDNM1ALDH1A1FDPSLMNA
SCHEMBL19462782 0.86 TSHR (0.46) TSHRDNM1ALDH1A1FDPSLMNA

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
EP-0744450-A2 Aqueous compositions containing acetoacetate functional polymer and multifunctional amine ROHM AND HAAS COMPANY (US) 1996-11-27 EP disclosed