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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201797

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWW0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORN0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORP0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,E,F2FCC0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWV0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2EA00.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1HU00.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,I,J,
K,L
1K820.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1L1Z0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEE1LWY0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,D,F2OQ40.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C1K3X0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1K3W0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2OPF0.71
G3PSN-GLYCEROL-3-PHOSPHATEA,B1Y380.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B1WBJ0.83
G3PSN-GLYCEROL-3-PHOSPHATEB6TIM0.83
G3PSN-GLYCEROL-3-PHOSPHATEA3EKZ0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B2TSY0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B1Z820.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1IXN0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B1DC40.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1IXO0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1FDJ0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B2J9X0.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B,C,D1QI10.83
G3PSN-GLYCEROL-3-PHOSPHATEA,B1OF80.83
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B1ZZB0.7
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B1ZZ70.7
S0H(S)-2-HYDROXYPROPYLPHOSPHONIC ACIDA,B,C1ZZ80.7
P23PROPYL TRIHYDROGEN DIPHOSPHATEA,B1T9A0.74
P23PROPYL TRIHYDROGEN DIPHOSPHATEA,B1T9C0.74
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5S0.86
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5R0.86
GP9(2R)-2,3-dihydroxypropyl phosphateA2W5T0.86
P1P3-{[OXIDO(OXO)PHOSPHINO]OXY}PROPAN-
1-OLATE
A,B,D2D2L0.83
G2H2-HYDROXY-1-(HYDROXYMETHYL)ETHYL DIHYDROGEN PHOSPHATEA,B,C,D1WOA0.83
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,D1NNJ0.96
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
B,C2NPZ0.96
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,D1PJI0.96
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
A,B,D,G1KFV0.96
PDIPHOSPHORIC ACID MONO-(3-HYDROXY-
PROPYL) ESTER
B1EJZ0.96
ISPPHOSPHORYLISOPROPANEF,G1GMH0.71
ISPPHOSPHORYLISOPROPANEA1TRY0.71
ISPPHOSPHORYLISOPROPANEA,B1TRN0.71
1GPSN-GLYCEROL-1-PHOSPHATEA,B2F6X0.83
1GPSN-GLYCEROL-1-PHOSPHATEA,B,C,D2VYV0.83
EFSETHYL DIHYDROGEN PHOSPHATEA1XLV0.76
EFSETHYL DIHYDROGEN PHOSPHATEA,B1P6B0.76
EFSETHYL DIHYDROGEN PHOSPHATEA,B3CAK0.76
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA1NTP0.71
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA1XLU0.71
MIPMONOISOPROPYL ESTER PHOSPHONIC ACIDA,B1O6E0.71
DPFDIETHYL HYDROGEN PHOSPHATEA2R1M0.7
DPFDIETHYL HYDROGEN PHOSPHATEA2R1K0.7
DPFDIETHYL HYDROGEN PHOSPHATEA,B3CAK0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YBH0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YHZ0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YI10.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B,C,D1T9D0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YI00.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA1YHY0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B1T9B0.7
P22ETHYL DIHYDROGEN DIPHOSPHATEA,B1T9C0.7
ATJETHYL HYDROGEN PHOSPHONATEA,B2C0P0.72
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1K8Y0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1FDJ0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B3BXE0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1ADO0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2QUU0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B2R4E0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1NF00.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
2QJH0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D3DFO0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
2QJI0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J
1OK40.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA3BV40.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D3DFS0.8
13P1,3-DIHYDROXYACETONEPHOSPHATES1E480.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA3EKZ0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA3EKL0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1WPQ0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1J4E0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B2R4J0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA2V2A0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2QUT0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B3BXF0.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2FJK0.8
13P1,3-DIHYDROXYACETONEPHOSPHATES1E470.8
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1NEY0.8