Hydrochlorthiazide

Hydrochlorthiazide

SCHEMBL28330583

COCCn1ccc(N)n1.c1cscn1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAP4K4 O95819 1/20 0.33
EGFR P00533 1/20 0.33
FRK P42685 1/20 0.33
MAPK9 P45984 1/20 0.33
CSNK1D P48730 1/20 0.33
SLK Q9H2G2 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
IGF1R P08069 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL1079285 0.84 ALDH1A1 (0.42) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL15150212 0.75 ALDH1A1 (0.41) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL18235389 0.71 MAP4K4 (0.41) ALDH1A1TDP1MAP4K4MEN1KMT2A
SCHEMBL21787714 0.68 MPO (0.36) ALDH1A1TDP1MAP4K4EGFRFRK
SCHEMBL6305075 0.68 KDM4E (0.38) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL15880359 0.67 ALDH1A1 (0.40) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL1082035 0.67 ALDH1A1 (0.40) ALDH1A1TDP1MEN1KMT2AL3MBTL1
SCHEMBL24915251 0.66 IRAK4 (0.35) ALDH1A1MAP4K4EGFRFRKMAPK9
SCHEMBL13242164 0.66 THRB (0.40) ALDH1A1MAP4K4EGFRFRKMAPK9
SCHEMBL1859454 0.65

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
CN-110506043-A COMPOUNDS USEFUL AS RET INHIBITORS CANCER RES TECH LIMITED 2019-11-26 CN disclosed