Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL28126176

COC(=O)c1ccnc(-c2ccccc2)n1.N

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KMT2A Q03164 1/20 0.47
HDAC6 Q9UBN7 1/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPK1 P28482 2/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
PDE5A O76074 1/20 0.42
ABCC1 P33527 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
KDM6B O15054 1/20 0.42
KDM5C P41229 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
KDM2A Q9Y2K7 1/20 0.42
KDM3A Q9Y4C1 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 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
SCHEMBL14741986 0.98 MAPT (0.48) MAPTKMT2AHDAC6TSHRALDH1A1
SCHEMBL25002922 0.83 KMT2A (0.56) MAPTKMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL22027749 0.83 KMT2A (0.42) MAPTKMT2AALDH1A1KDM4EMAPK1
SCHEMBL25002890 0.83 MAP4K4 (0.51) MAPTKMT2AALDH1A1KDM4EHSD17B10
SCHEMBL13728355 0.82 HDAC6 (0.50) MAPTKMT2AHDAC6ALDH1A1HPGD
SCHEMBL15349749 0.82 ALDH1A1 (0.59) MAPTKMT2ATSHRALDH1A1KDM4E
SCHEMBL696116 0.80 XDH (0.50) MAPTKMT2AHDAC6TSHRALDH1A1
SCHEMBL25002930 0.80 RAB9A (0.49) MAPTKMT2AALDH1A1KDM4EHPGD
SCHEMBL29214336 0.80 ALDH1A1 (0.56) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL20743540 0.79 MAPK1 (0.44) MAPTALDH1A1KDM4EMAPK1KDM6B

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-106518845-A Kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof CHDI基金会股份有限公司 2017-03-22 CN disclosed