Mercaptopropionic Acid

Mercaptopropionic Acid

SCHEMBL9715938

C=C(C)C(=O)Oc1ccccc1Cl.O=C(O)CCS

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
CXCL8 P10145 1/20 0.41
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
CAMK2A Q9UQM7 1/20 0.36
MAPT P10636 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
PTK2B Q14289 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
PTGS2 P35354 1/20 0.36
PKM P14618 1/20 0.35
BCHE P06276 1/20 0.35
RAB9A P51151 1/20 0.35
FFAR1 O14842 1/20 0.35

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
Thioglycolic Acid SCHEMBL9716016 0.90 ELANE (0.44) ELANECXCL8HPGDRXRARXRB
SCHEMBL964110 0.85 ELANE (0.49) ELANECXCL8LMNAHPGDRXRA
Thiosalicylic Acid SCHEMBL9716030 0.77 MAPT (0.51) ELANELMNAHPGDRXRARXRB
SCHEMBL9716025 0.74 ESR1 (0.43) ELANELMNAHPGDTP53HTT
SCHEMBL8604701 0.74 PTGS2 (0.39) ELANEHPGDMAPTPTK2BMEN1
Mercaptopropionic Acid SCHEMBL27418291 0.73 ACE (0.40) LMNA
SCHEMBL5790498 0.73 MAPT (0.46) CXCL8LMNAHPGDRXRARXRB
SCHEMBL9716038 0.73 ESR1 (0.42) ELANELMNAHPGDTP53HTT
SCHEMBL2947498 0.73 PTK2B (0.51) CXCL8LMNAHPGDRXRARXRB
SCHEMBL1232932 0.73 ELANE (0.56) ELANELMNAHPGDTP53KMT2A

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-5147752-A Crosslinked binder FUJI PHOTO FILM CO., LTD. (JP) 1992-09-15 US disclosed