Acetamide

Acetamide

SCHEMBL3550862

CC(N)=O.CNc1nc2[nH]c(-c3cccc(CNC(=O)CNC(C)=O)c3)cc2c2c1ncn2C

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 19/20 0.86
CHUK O15111 13/20 0.86
RET P07949 1/20 0.56
CYP2C9 P11712 1/20 0.56
EPHA1 P21709 1/20 0.56
FLT4 P35916 1/20 0.56
KDR P35968 1/20 0.56
EPHB1 P54762 1/20 0.56
PTK6 Q13882 1/20 0.56
CDK2 P24941 1/20 0.56
BTK Q06187 1/20 0.56
ITK Q08881 1/20 0.56
IKBKE Q14164 1/20 0.56

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
SCHEMBL2768787 0.98 IKBKB (0.90) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2768248 0.93 IKBKB (1.00) IKBKBCHUKCDK2BTKITK
SCHEMBL2768217 0.91 IKBKB (0.87) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2768682 0.90 IKBKB (0.85) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2766134 0.90 IKBKB (0.86) IKBKBCHUK
SCHEMBL2767351 0.89 IKBKB (1.00) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2768097 0.89 IKBKB (0.88) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2766541 0.89 IKBKB (1.00) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL2766177 0.88 IKBKB (0.86) IKBKBCHUKRETCYP2C9EPHA1
SCHEMBL3039640 0.88 IKBKB (0.79) IKBKBCHUKRETCYP2C9EPHA1

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-7737279-B2 1,6-dihydro-1,3,5,6-tetraaza-as-indacene based tricyclic compounds and pharmaceutical compositions comprising same BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-15 US claimed