Methylamine

Methylamine

SCHEMBL8701837

CC(C)(C)OC(=O)c1ccc(-c2ccccc2C#N)cc1.CN

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.53
ESR2 Q92731 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
PTPN1 P18031 1/20 0.46
PTPN5 P54829 1/20 0.46
FFAR1 O14842 1/20 0.41
AKR1B1 P15121 1/20 0.41
OXTR P30559 2/20 0.41
AVPR1A P37288 2/20 0.41
GRIA2 P42262 1/20 0.40
GRIA4 P48058 1/20 0.40
FFAR2 O15552 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
PDK2 Q15119 1/20 0.38

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
SCHEMBL6165708 0.81 ESR2 (0.56) GPR119ESR2CA12CA1CA2
SCHEMBL6164774 0.78 TTK (0.55) GPR119ESR2PTPN1PTPN5S1PR1
Hydrogen Sulfide SCHEMBL27727970 0.78 CA12 (0.53) CA12CA1CA2CA9CA14
SCHEMBL8701834 0.76 PAX8 (0.50) GPR119ESR2PTPN1PTPN5FFAR1
SCHEMBL6414144 0.76 ESR2 (0.61) GPR119ESR2PTPN5FFAR1AKR1B1
SCHEMBL9173605 0.76 CA12 (0.45) GPR119CA12CA1CA2CA9
SCHEMBL7545306 0.75 PTPN1 (0.53) GPR119ESR2PTPN1PTPN5FFAR1
SCHEMBL2039846 0.75 ESR2 (0.62) ESR2PTPN5FFAR1AKR1B1GRIA2
SCHEMBL6959964 0.74 PTPN1 (0.57) GPR119ESR2PTPN1PTPN5FFAR1
SCHEMBL6355405 0.74 CA12 (0.63) CA12CA1CA2CA9CA14

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
US-5726319-A Biphenyl substituted dipeptide analogs promote release of growth hormone MERCK & CO., INC. (US) 1998-03-10 US disclosed