Mercaptopropionic Acid

Mercaptopropionic Acid

SCHEMBL11845992

CCCC(C)S.O=C(O)CCS

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
FFAR3 O14843 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
ACE P12821 1/20 0.41
FOLH1 Q04609 5/20 0.41
ANPEP P15144 4/20 0.41
ENPEP Q07075 4/20 0.41
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40

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
Mercaptopropionic Acid SCHEMBL30969476 0.85 HDAC1 (0.44) HDAC1HDAC2FFAR3HDAC3HDAC8
2-Pentanol SCHEMBL8003002 0.83 HDAC1 (0.42) HDAC1HDAC2FFAR3HDAC3HDAC8
Propionic Acid SCHEMBL1245621 0.82 FFAR3 (0.50) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL28071539 0.81 HDAC1 (0.44) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL3094964 0.81 HDAC1 (0.44) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL18423364 0.80 ACE (0.50) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL8724601 0.79 FFAR3 (0.58) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL970738 0.79 FFAR3 (0.58) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL29416210 0.79 HDAC1 (0.38) HDAC1HDAC2FFAR3HDAC3HDAC8
Mercaptopropionic Acid SCHEMBL7183577 0.78 ACE (0.48) ACEFOLH1ANPEPENPEPGABRP

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-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed