Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL21830397

C1=Cc2cccc3cccc(c23)C1.C1=Cc2cccc3cccc(c23)C1.C1=Cc2cccc3cccc(c23)C1.N

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
CYP3A4 P08684 2/20 0.41
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 4/20 0.35
HPGD P15428 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
KDM4E B2RXH2 2/20 0.34
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
TYMS P04818 1/20 0.32
LMNA P02545 1/20 0.32
PARP1 P09874 1/20 0.32
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
Ammonia Solution, Strong SCHEMBL10534318 1.00 TSHR (0.41) TSHRCYP3A4CA1CA2ALDH1A1
Ammonia Solution, Strong SCHEMBL977994 1.00 TSHR (0.41) TSHRCYP3A4CA1CA2ALDH1A1
Ammonia Solution, Strong SCHEMBL2143516 1.00 TSHR (0.41) TSHRCYP3A4CA1CA2ALDH1A1
Fluoride SCHEMBL27714588 0.98 CYP3A4 (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Ammonia Solution, Strong SCHEMBL7262979 0.98 CYP3A4 (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Fluoride SCHEMBL27714590 0.98 CYP3A4 (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Ammonia Solution, Strong SCHEMBL28887351 0.98 CYP3A4 (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Methane SCHEMBL17330285 0.98 CYP3A4 (0.40) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL7432807 0.98 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL17685497 0.98 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1

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
WO-2020071646-A1 POLARIZING PLATE AND OPTICAL DISPLAY DEVICE INCLUDING SAME 삼성에스디아이 주식회사 2020-04-09 WO disclosed