Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4939360

N.O=CCc1cccc(F)c1[N+](=O)[O-]

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGMT P16455 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 8/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HPGD P15428 1/20 0.36
NR1D1 P20393 1/20 0.34
NR1H3 Q13133 1/20 0.34
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
ALDH3A1 P30838 1/20 0.33
TSHR P16473 2/20 0.33
GPR35 Q9HC97 1/20 0.33
MAPT P10636 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NTSR1 P30989 1/20 0.31

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
SCHEMBL22121304 0.98 MGMT (0.38) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL31392289 0.82 MGMT (0.39) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL11002560 0.79 TSHR (0.50) ALDH1A1TDP1KMT2AHPGDLMNA
SCHEMBL214271 0.79 ALDH1A1 (0.45) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL22394589 0.78 HSP90AA1 (0.40) CYP2C19ALDH1A1TDP1MEN1KMT2A
SCHEMBL18894093 0.78 ALDH1A1 (0.33) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL16950621 0.77 ALDH1A1 (0.41) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL20560654 0.77 ALDH1A1 (0.52) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL962484 0.77 MGMT (0.40) MGMTCYP1A2CYP2C19ALDH1A1TDP1
SCHEMBL29961217 0.77 ALDH1A1 (0.41) MGMTCYP1A2CYP2C19ALDH1A1TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1705482-B1 METHOD OF DETECTION, SEPARATION AND IDENTIFICATION FOR EXPRESSED TRACE PROTEIN/PEPTIDE IMAI KAZUHIRO (JP) 2017-09-27 EP disclosed
US-8796037-B2 Method of detection, separation and identification for expressed trace protein/peptide IMAI KAZUHIRO (JP) 2014-08-05 US disclosed
US-20080280316-A1 Mass spectrometry; liquid chromatography; automatic fractionation IMAI KAZUHIRO 2008-11-13 US disclosed
EP-1705482-A2 METHOD OF DETECTION, SEPARATION AND IDENTIFICATION FOR EXPRESSED TRACE PROTEIN/PEPTIDE Imai, Kazuhiro (JP) 2006-09-27 EP disclosed