Biguanide

Biguanide

SCHEMBL28973152

CC(NC(CCCNC(=N)N)C(=O)O)C(=O)O.N=C(N)NC(=N)N

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.34
NPY4R P50391 11/20 0.34
NPY1R P25929 8/20 0.34
NPY5R Q15761 7/20 0.34
NPY2R P49146 4/20 0.34
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
C3AR1 Q16581 1/20 0.33
ALOX15 P16050 1/20 0.32
ACE P12821 2/20 0.32
NOD1 Q9Y239 1/20 0.32

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
SCHEMBL4572687 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL4572685 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL163852 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL4572695 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL638492 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL4572697 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL30493180 0.96 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
SCHEMBL30664363 0.94 FOLH1 (0.36) FOLH1NPY4RNPY1RNPY5RNPY2R
Bromomethane SCHEMBL28338901 0.93 FOLH1 (0.35) FOLH1NPY4RNPY1RNPY5RNPY2R
Cadaverine Tartrate SCHEMBL28445405 0.90 FOLH1 (0.34) FOLH1NPY4RNPY1RNPY5RNPY2R

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
CN-113271780-B Bacillus amyloliquefaciens FCC1256 composition and method for controlling plant pathogens FMC公司 2023-03-28 CN disclosed