Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6400229

CC(C)/C=C(\C#N)CC(=O)O.N

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.32
GRIA2 P42262 2/20 0.32
GRIA4 P48058 2/20 0.32
GRIK3 Q13003 2/20 0.32
GRIK5 Q16478 2/20 0.32
GRIA1 P42261 1/20 0.32
GRIK2 Q13002 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LDHA P00338 1/20 0.31
SRR Q9GZT4 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
Ammonia Solution, Strong SCHEMBL6400231 1.00 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL13851870 0.98 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL4145834 0.98 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL4145829 0.98 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
Tert-Butylamine SCHEMBL4147578 0.89 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
Tert-Butylamine SCHEMBL4147580 0.89 GRIK1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
Potassium Ion SCHEMBL6395315 0.78 CA4 (0.33)
SCHEMBL5364063 0.78 MGAM (0.37) ALDH1A1
Potassium Ion SCHEMBL6395320 0.78 CA4 (0.33)
SCHEMBL5364066 0.78 MGAM (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6891059-B2 Asymmetric synthesis of pregabalin WARNER-LAMBERT COMPANY (US) 2005-05-10 US disclosed
EP-1250311-B1 ASYMMETRIC SYNTHESIS OF PREGABALIN WARNER LAMBERT CO (US) 2004-03-17 EP disclosed
US-20030212290-A1 Asymmetric synthesis of pregabalin BURK MARK JOSEPH (US) 2003-11-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030212290-A1 Asymmetric synthesis of pregabalin GABRA5, GABRA6, GABRE GRIK1 59/4885GRIA2 45/4885GRIA4 71/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.