Mercaptopropionic Acid

Mercaptopropionic Acid

SCHEMBL28079602

O=C(O)CCS.[CH2]CCCCCCCCCCSC(C)=O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 6/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
FOLH1 Q04609 2/20 0.35
ACE P12821 1/20 0.34
CYP2C19 P33261 1/20 0.32
TSHR P16473 6/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
BLM P54132 1/20 0.32
ATM Q13315 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6843334 0.84 CYP2C19 (0.43) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL25281666 0.84 CYP2C19 (0.43) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL12506492 0.84 CYP2C19 (0.43) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL6843354 0.84 CYP2C19 (0.43) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL2289375 0.82
SCHEMBL15135057 0.78 TSHR (0.55) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL1647647 0.78 TSHR (0.55) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL3799172 0.78 TSHR (0.55) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL3905981 0.78 TSHR (0.55) HDAC11HDAC3HDAC4HDAC1HDAC7
SCHEMBL3330553 0.78 TSHR (0.55) HDAC11HDAC3HDAC4HDAC1HDAC7

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
CN-105766990-B As preservative for agricultural, bismuth-mercaptan of industry and other purposes 微生物公司 2019-08-02 CN disclosed
CN-105766990-A Bismuth-thiols As Antiseptics For Epithelial Tissues, Acute And Chronic Wounds, Bacterial Biofilms And Other Indications 微生物公司 2016-07-20 CN disclosed