Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL11636588

CCC(C)C(=O)C12CC3CC(CC(C3)C1)C2.N

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD11B1 P28845 1/20 0.41
LMNA P02545 1/20 0.40
CA2 P00918 1/20 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
SCHEMBL1082701 0.77 ALDH1A1 (0.56) HSD17B10ALDH1A1MAPTHSD11B1CA2
SCHEMBL19718856 0.77 ALDH1A1 (0.56) HSD17B10ALDH1A1MAPTHSD11B1CA2
SCHEMBL4051756 0.77 HSD17B10 (0.46) HSD17B10ALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL26081355 0.75 ALDH1A1 (0.55) HSD17B10ALDH1A1MAPTHSD11B1CA2
SCHEMBL11635652 0.74 ALDH1A1 (0.53) HSD17B10ALDH1A1MAPTCA2
SCHEMBL2526511 0.74 ALDH1A1 (0.53) HSD17B10ALDH1A1MAPTHSD11B1LMNA
SCHEMBL4474350 0.74 HSD17B10 (0.54) HSD17B10ALDH1A1MAPTHSD11B1CA2
SCHEMBL16682462 0.73 ALDH1A1 (0.47) ALDH1A1MAPTKMT2ALMNA
SCHEMBL14696638 0.72 ALDH1A1 (0.51) HSD17B10ALDH1A1MAPTSMN1; SMN2HSD11B1
SCHEMBL29300322 0.71 KMT2A (0.32) KMT2ASMN1; SMN2

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-4100170-A ANTIHYPERTENSIVE AGENTS, MONOAMINE OXIDASE INHIBITORS PENNWALT CORPORATION (US) 1978-07-11 US disclosed