Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6061986

COc1ccc(CN)cn1.N

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.52
LOX P28300 1/20 0.52
NNMT P40261 1/20 0.46
MAOB P27338 2/20 0.42
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
KLKB1 P03952 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
CYP11B1 P15538 1/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40
TUBB8 Q3ZCM7 1/20 0.40
TUBA3E Q6PEY2 1/20 0.40

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
SCHEMBL29658888 0.98 LOXL2 (0.53) LOXL2LOXNNMTMAOBKDM1A
SCHEMBL1146238 0.98 LOXL2 (0.53) LOXL2LOXNNMTMAOBKDM1A
SCHEMBL5547238 0.98 LOXL2 (0.53) LOXL2LOXNNMTMAOBKDM1A
Hydrochloric Acid SCHEMBL5013392 0.96 LOXL2 (0.52) LOXL2LOXNNMTMAOBKDM1A
Hydrochloric Acid SCHEMBL6234391 0.96 LOXL2 (0.52) LOXL2LOXNNMTMAOBKDM1A
SCHEMBL5013531 0.86 NNMT (0.46) LOXL2LOXNNMTKLKB1MKNK1
SCHEMBL31666977 0.82 TAAR1 (0.52) LOXL2LOXNNMTMAOBKDM1A
SCHEMBL1967473 0.82 TAAR1 (0.52) LOXL2LOXNNMTMAOBKDM1A
Hydrochloric Acid SCHEMBL5688361 0.81 TAAR1 (0.50) LOXL2LOXNNMTMAOBKDM1A
SCHEMBL20771833 0.80 MAOB (0.51) LOXL2LOXMAOBKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720856-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2006-11-15 EP disclosed
WO-2005077050-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-08-25 WO disclosed