Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL7718335

CCCCc1cccc(C(=O)O)c1CCCC.N

nearest known ligand 0.49

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.49
MCL1 Q07820 6/20 0.49
BCL2L1 Q07817 5/20 0.49
BAK1 Q16611 5/20 0.49
PPARA Q07869 3/20 0.49
KAT8 Q9H7Z6 2/20 0.49
PPARG P37231 2/20 0.49
SAE1 Q9UBE0 2/20 0.49
EP300 Q09472 1/20 0.49
KAT2A Q92830 1/20 0.49
KAT2B Q92831 1/20 0.49
KAT5 Q92993 1/20 0.49
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44

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
Ammonia Solution, Strong SCHEMBL7718333 1.00 BID (0.49) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL169572 0.98 BID (0.50) BIDMCL1BCL2L1BAK1PPARA
Ammonia Solution, Strong SCHEMBL7713415 0.94 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
Ammonia Solution, Strong SCHEMBL7713414 0.94 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL27782113 0.94 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL906286 0.94 BID (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL15344563 0.93 BID (0.45) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL28370702 0.93 BID (0.56) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL11668026 0.92 BID (0.59) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL8734778 0.92 BID (0.59) BIDMCL1BCL2L1BAK1PPARA

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-6383275-B1 MIXTURE OF WATER, COLORANT AD WATER SOLUBLE DISCOLORATION INHIBITOR XEROX CORPORATION 2002-05-07 US claimed
US-6383275-B1 MIXTURE OF WATER, COLORANT AD WATER SOLUBLE DISCOLORATION INHIBITOR XEROX CORPORATION 2002-05-07 US disclosed