Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL9169933

CCCCc1ccc(OC)cc1.N

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.62
LMNA P02545 2/20 0.59
GAA P10253 2/20 0.59
MEN1 O00255 1/20 0.59
ALDH1A1 P00352 1/20 0.59
MAPT P10636 1/20 0.59
HPGD P15428 1/20 0.59
ALOX12 P18054 1/20 0.59
MAPK1 P28482 1/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
TAAR1 Q96RJ0 1/20 0.57
HTT P42858 1/20 0.56
IGF1R P08069 1/20 0.55
ALOX15 P16050 1/20 0.55
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54

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
SCHEMBL145506 0.98 CALM1 (0.64) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL10569250 0.96 CALM1 (0.62) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL27914349 0.96 CALM1 (0.68) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL10571667 0.94 CALM1 (0.60) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL13579997 0.92 MAOB (0.63) CALM1LMNAGAAMEN1ALDH1A1
Ammonia Solution, Strong SCHEMBL9061621 0.92 CASP3 (0.59) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL581719 0.91 CASP3 (0.63) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL10568997 0.91 CASP3 (0.63) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL10534584 0.89 CASP3 (0.61) CALM1LMNAGAAMEN1ALDH1A1
SCHEMBL10533113 0.89 CASP3 (0.61) CALM1LMNAGAAMEN1ALDH1A1

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
CN-101222916-A Phenol derivatives and their use to modulate PKB activity IMP INNOVATIONS LTD (GB) 2008-07-16 CN disclosed
EP-0443606-B1 4-(4-alkoxyphenyl)-2-butylamine derivatives and process therefor SHIONOGI & CO (JP) 1995-05-10 EP disclosed
US-5073648-A Intermediates for dopamine derivatives SHIONOGI & CO., LTD. (JP) 1991-12-17 US disclosed
EP-0443606-A2 4-(4-alkoxyphenyl)-2-butylamine derivatives and process therefor SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-08-28 EP disclosed