Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL5367620

N.NCCCCCCC(=O)C(F)(F)F

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.69
▸ FAAH O00519 14/20 0.59
▸ CES1 P23141 10/20 0.59
▸ CES2 O00748 2/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.50
▸ PLG P00747 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ SLC6A2 P23975 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ SLC6A3 Q01959 1/20 0.50
▸ PAOX Q6QHF9 1/20 0.48

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
SCHEMBL9338632 0.88 HDAC6 (0.64) HDAC6FAAHCES1CES2MEN1
SCHEMBL7393724 0.81 FAAH (0.64) HDAC6FAAHCES1CES2MEN1
SCHEMBL23465657 0.80 PAOX (0.52) HDAC6FAAHCES1CES2MEN1
SCHEMBL3775993 0.78 — —
SCHEMBL10697629 0.76 FAAH (0.64) HDAC6FAAHCES1CES2MEN1
SCHEMBL7371814 0.76 FAAH (0.64) HDAC6FAAHCES1CES2MEN1
SCHEMBL2222667 0.76 FAAH (0.64) HDAC6FAAHCES1CES2MEN1
SCHEMBL10388810 0.76 FAAH (0.64) HDAC6FAAHCES1CES2MEN1
Trifluoroacetic Acid SCHEMBL28761253 0.76 LMNA (0.54) HDAC6MEN1KMT2ACYP1A2ALDH1A1
Trifluoroacetic Acid SCHEMBL1930024 0.76 LMNA (0.54) HDAC6MEN1KMT2ACYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223833-B1 Peptide nucleic acid conjugates ISIS PHARMACEUTICALS, INC. (US) 2007-05-29 — — US disclosed
EP-0804456-B1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS INC (US) 2002-08-21 — — EP disclosed
EP-0804456-A4 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS INC (US) 1999-05-19 — — EP disclosed
EP-0804456-A1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS, INC. (US) 1997-11-05 — — EP disclosed
WO-1996011205-A9 PEPTIDE NUCLEIC ACID CONJUGATES — 1996-05-30 — — WO disclosed
WO-1996011205-A1 PEPTIDE NUCLEIC ACID CONJUGATES ISIS PHARMACEUTICALS, INC. (US) 1996-04-18 — — WO disclosed
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