Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL11355844

CC(=O)OC[C@]1(C)CCC[C@]2(C)[C@H]3CCC(C(C)C)=CC3=CC[C@@H]12.N

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.70
▸ LMNA P02545 3/20 0.70
▸ ALDH1A1 P00352 2/20 0.70
▸ MAPK1 P28482 1/20 0.70
▸ HSD17B10 Q99714 3/20 0.63
▸ PDK1 Q15118 2/20 0.63
▸ PDK2 Q15119 2/20 0.63
▸ PDK3 Q15120 2/20 0.63
▸ PDK4 Q16654 2/20 0.63
▸ CYP3A4 P08684 2/20 0.63
▸ SLCO1B3 Q9NPD5 1/20 0.63
▸ SLCO1B1 Q9Y6L6 1/20 0.63
▸ GABRA1 P14867 1/20 0.63
▸ GABRB2 P47870 1/20 0.63
▸ MAPT P10636 1/20 0.63
▸ CYP2C9 P11712 1/20 0.63
▸ CYP2C19 P33261 1/20 0.63
▸ KDM4E B2RXH2 1/20 0.63
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50

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
SCHEMBL2447909 0.99 ALOX15 (0.72) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL2447910 0.99 ALOX15 (0.72) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL9081869 0.89 ALOX15 (0.67) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL9081871 0.89 ALOX15 (0.67) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL9490274 0.87 ALOX15 (0.67) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL9490280 0.87 ALOX15 (0.67) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL13098543 0.87 ALOX15 (0.67) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL9559219 0.87 ALOX15 (0.66) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL8746013 0.86 ALOX15 (0.77) ALOX15LMNAALDH1A1MAPK1HSD17B10
SCHEMBL8746011 0.86 ALOX15 (0.77) ALOX15LMNAALDH1A1MAPK1HSD17B10

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
US-4279653-A WATER SOLUBLE WETTING AGENTS AND DYES AND A SULFITE OXYGEN ABSORBER DAI NIPPON TORYO CO., LTD. (JP) 1981-07-21 — — US disclosed
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