Sugi Predict

Sugi Predict / Compounds / Butylamine

Butylamine

Butylamine

SCHEMBL10872129

C=C(CCCN=C=O)C(=O)O.CCCCN

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.33
▸ GRIK2 Q13002 1/20 0.33
▸ GRM1 Q13255 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ THRB P10828 1/20 0.30
▸ FNTA P49354 1/20 0.30
▸ FNTB P49356 1/20 0.30
▸ PGGT1B P53609 1/20 0.30
▸ TET2 Q6N021 3/20 0.30
▸ TET3 O43151 1/20 0.30
▸ TET1 Q8NFU7 1/20 0.30

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
SCHEMBL15427 0.85 TET2 (0.39) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL890544 0.84 TET2 (0.33) GRIK1GRIK2GRM1GRM2TET2
Acetone SCHEMBL5519066 0.84 TET2 (0.35) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL33514 0.80 TBXAS1 (0.36) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL5685778 0.79 CAMK2A (0.35) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL448594 0.79 TBXAS1 (0.38) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL2358462 0.79 TBXAS1 (0.38) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL448242 0.79 TBXAS1 (0.38) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL445702 0.79 TBXAS1 (0.38) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL445917 0.79 TBXAS1 (0.38) GRIK1GRIK2GRM1GRM2TET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0188895-A1 Hydrophilic silicone-organic copolymer elastomers DOW CORNING CORPORATION (US) 1986-07-30 — — EP disclosed