Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL7718345

CCCCCCCCCCCCc1c(C)cc2ccccc2c1C(=O)O.N

nearest known ligand 0.49

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
MEN1 O00255 1/20 0.49
CYP1A2 P05177 1/20 0.49
GLA P06280 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 1/20 0.46
BID P55957 3/20 0.45
MCL1 Q07820 3/20 0.45
PPARA Q07869 3/20 0.45
BCL2L1 Q07817 2/20 0.45
BAK1 Q16611 2/20 0.45
KAT8 Q9H7Z6 2/20 0.45
PPARG P37231 2/20 0.45
EP300 Q09472 1/20 0.45
KAT2A Q92830 1/20 0.45
KAT2B Q92831 1/20 0.45

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 SCHEMBL7718348 1.00 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10MEN1
Ammonia Solution, Strong SCHEMBL7713469 0.88 BID (0.50) KDM4EALDH1A1HPGDHSD17B10MEN1
Ammonia Solution, Strong SCHEMBL7713467 0.88 BID (0.50) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL28330445 0.88 MAPT (0.47) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL27266684 0.86 BID (0.51) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL163402 0.86 BID (0.51) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL1176173 0.86 BID (0.51) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL28277939 0.85 BID (0.50) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL27715457 0.85 BID (0.50) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL7594370 0.85 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10MEN1

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