Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8958644

N.N.O=C(O)CCSSCCC(=O)O

nearest known ligand 0.93

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.93
LMNA P02545 6/20 0.65
KMT2A Q03164 1/20 0.65
HSD17B10 Q99714 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
EGLN1 Q9GZT9 2/20 0.53
ALKBH5 Q6P6C2 1/20 0.53
SUCNR1 Q9BXA5 1/20 0.53
CYP1A2 P05177 1/20 0.48
SLC22A6 Q4U2R8 1/20 0.47
FOLH1 Q04609 1/20 0.46
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
NFKB1 P19838 1/20 0.44
PMP22 Q01453 1/20 0.44
APEX1 P27695 1/20 0.42
FFAR3 O14843 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42

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
SCHEMBL95982 0.96 TSHR (1.00) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL9001014 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Selenium SCHEMBL30845448 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Hydrochloric Acid SCHEMBL10457214 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL30845449 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Hydrogen Sulfide SCHEMBL28318293 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
SCHEMBL342096 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Water SCHEMBL11221867 0.93 TSHR (0.93) TSHRLMNAKMT2AHSD17B10TDP1
Acetic Acid SCHEMBL6932730 0.87 TSHR (0.81) TSHRLMNAKMT2AHSD17B10TDP1
Ethylene Glycol SCHEMBL28363318 0.87 TSHR (0.81) TSHRLMNAKMT2AHSD17B10TDP1

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-5520909-A WATER SOLUBLE DISULFIDES AND MERCAPTAN REDUCING AGENTS FOR RELAXING HAIR CONAIR CORPORATION (US) 1996-05-28 US claimed