Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL9720328

CCC(C)C(C(=O)O)C(C)(O)c1cnccn1.N

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
CYP19A1 P11511 1/20 0.35
KDM4E B2RXH2 4/20 0.35
HTT P42858 2/20 0.35
GAA P10253 1/20 0.34
THRB P10828 1/20 0.34
RAB9A P51151 2/20 0.33
KMT2A Q03164 1/20 0.33
LONP1 P36776 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
POLB P06746 1/20 0.32
NPC1 O15118 1/20 0.32
RIPK1 Q13546 1/20 0.31

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
SCHEMBL9720324 0.99 LMNA (0.39) LMNACYP19A1KDM4EHTTGAA
SCHEMBL9720347 0.85 CYP19A1 (0.35) LMNACYP19A1KDM4EHTTGAA
SCHEMBL11068158 0.84 SMN1; SMN2 (0.37) LMNACYP19A1KDM4EHTTRAB9A
Ammonia Solution, Strong SCHEMBL9720294 0.77 CYP3A4 (0.43) LMNACYP19A1KDM4ERAB9AKMT2A
Ammonia Solution, Strong SCHEMBL9720345 0.76 KIF11 (0.36) LMNACYP19A1HTTGAASMN1; SMN2
SCHEMBL9720309 0.76 CYP3A4 (0.43) LMNACYP19A1KDM4ERAB9AKMT2A
SCHEMBL9720368 0.76 DPP8 (0.36) RAB9AKMT2APOLBNPC1
SCHEMBL9720359 0.74 KIF11 (0.37) LMNACYP19A1HTTGAASMN1; SMN2
SCHEMBL781413 0.72 CYP19A1 (0.43) LMNACYP19A1KDM4ERAB9ALONP1
SCHEMBL781412 0.72 CYP19A1 (0.43) LMNACYP19A1KDM4ERAB9ALONP1

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-5148817-A Heterocyclic hydroxy-substituted carboxylic compound as flavor additive PHILIP MORRIS INCORPORATED (US) 1992-09-22 US claimed