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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02863565

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BG1O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]-
L-serine
A2RG30.71
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.72
THCN-METHYLCARBONYLTHREONINEB2HR00.72
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.72
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.72
LTA4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTERE,I1APT0.71
152CARNITINEA,B1NDF0.85
152CARNITINEA,B1T7Q0.85
152CARNITINEA,B1XL80.85
152CARNITINEA,B2H3U0.85
152CARNITINEA1S5O0.85
152CARNITINEA1T7O0.85
152CARNITINEA,B2H3P0.85
ALOALLO-THREONINEI,P1HDT0.72
ALOALLO-THREONINEA2JUU0.72
ALOALLO-THREONINEA2VMX0.72
OLTO-METHYL-L-THREONINEA,B,C2AOC0.71
OLTO-METHYL-L-THREONINEA,B,C2AOD0.71
OCBOCTANOYLCARNITINEA,B1XL80.73
DTHD-THREONINEA1KRO0.72
DTHD-THREONINEA,B,C,D3BOG0.72
DTHD-THREONINEA,B173D0.72
DTHD-THREONINEA209D0.72
DTHD-THREONINEA316D0.72
DTHD-THREONINEA,B2Q330.72
DTHD-THREONINEA2JUE0.72
DTHD-THREONINEA2D550.72
OPIPANTOTHENYL-AMINOETHANOL-11-PIVALIC ACIDA,B,C,D2VU10.71
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.72
DSEN-METHYL-D-SERINEC1CWH0.71
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.74
PAUPANTOTHENOIC ACIDA,B2F9W0.7
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.7
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.7
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.7
HC5(R)-3-CARBOXY-2-(HEXANOYLOXY)-N,N,N-
TRIMETHYLPROPAN-1-AMINIUM
A,B2H3W0.78