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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03444814

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OC9OCTAN-1-OLA1ZNH0.84
OC9OCTAN-1-OLA2QHV0.84
DE1DECAN-1-OLA1ZNL0.84
HTOHEPTANE-1,2,3-TRIOLH,L,M2HH10.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWT0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXK0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M1RZH0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2HG30.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX30.8
HTOHEPTANE-1,2,3-TRIOLA2PIL0.8
HTOHEPTANE-1,2,3-TRIOLA,B1U190.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8D0.8
HTOHEPTANE-1,2,3-TRIOLA,B,C,D3DTU0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX40.8
HTOHEPTANE-1,2,3-TRIOLA,B1HZX0.8
HTOHEPTANE-1,2,3-TRIOLA,B2G870.8
HTOHEPTANE-1,2,3-TRIOLA,B2PED0.8
HTOHEPTANE-1,2,3-TRIOLC,H,L,M3D380.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWV0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M1RG50.8
HTOHEPTANE-1,2,3-TRIOLA1KMO0.8
HTOHEPTANE-1,2,3-TRIOLC,H,L,M1L9B0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWU0.8
HTOHEPTANE-1,2,3-TRIOLA1AY20.8
HTOHEPTANE-1,2,3-TRIOLA,B1RP00.8
HTOHEPTANE-1,2,3-TRIOLC,H,L,M2I5N0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8C0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2HJ60.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXJ0.8
HTOHEPTANE-1,2,3-TRIOLL,M1YF60.8
HTOHEPTANE-1,2,3-TRIOLB2BF30.8
HTOHEPTANE-1,2,3-TRIOLA,B2HPY0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX50.8
HTOHEPTANE-1,2,3-TRIOLL,M,X2UXM0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXL0.8
HTOHEPTANE-1,2,3-TRIOLA,B1L9H0.8
HTOHEPTANE-1,2,3-TRIOLA2HI20.8
HTOHEPTANE-1,2,3-TRIOLA,B,D,E,G,H,
J,K
1LGH0.8
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWW0.8
HE2HEXAN-1-OLA1ZNE0.74
MTLD-MANNITOLA,B1ZZU0.7
MTLD-MANNITOLA,B1ZZQ0.7
MTLD-MANNITOLA,B1M2W0.7
MTLD-MANNITOLA2VFU0.7
RNTL-RHAMNITOLA,B,C,D1DE50.73
MHN6-METHYLHEPTAN-1-OLA,B1OYF0.7
HE4HEPTAN-1-OLA1ZNG0.78
1DO1-DODECANOLA,Z2CFZ0.84
HND(4S)-nonane-1,4-diolA2KAR0.97
HND(4S)-nonane-1,4-diolA2KAS0.97
ODIOCTANE-1,8-DIOLA2DM50.84
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.71
CXLCYCLOHEXANOLA,B1HDX0.73
DEMDECYLOXY-METHANOLA1EK80.73
PL3HEXADECAN-1-OLA,B,C,D2UUU0.79
PL3HEXADECAN-1-OLA,B,C,D2UUV0.79
BDDBROMO-DODECANOLA1N8U0.7
BDDBROMO-DODECANOLA,B1N8V0.7
FOCFUCITOLA,B,C,D,E,F1FUI0.73
SORD-SORBITOLA1FQA0.7
SORD-SORBITOLA,B,C,D3XIM0.7
SORD-SORBITOLA2VFT0.7
SORD-SORBITOLA,B,C,D5XIM0.7
SORD-SORBITOLA3BRF0.7
SORD-SORBITOLA1XIH0.7
SORD-SORBITOLA2DXR0.7
SORD-SORBITOLA1D8C0.7
SORD-SORBITOLA,B,C,D2XIN0.7
SORD-SORBITOLA1FQB0.7
SORD-SORBITOLA,B4XIA0.7
HEZHEXANE-1,6-DIOLA,B1X1V0.74
HEZHEXANE-1,6-DIOLA,B,C,D,E,F1M8T0.74
HEZHEXANE-1,6-DIOLA1J7K0.74
HEZHEXANE-1,6-DIOLA2IOR0.74
HEZHEXANE-1,6-DIOLA,D2NY20.74
HEZHEXANE-1,6-DIOLA2NY00.74
HEZHEXANE-1,6-DIOLA,B,C,D3CDO0.74
HEZHEXANE-1,6-DIOLA,B,C,D2NXZ0.74
HEZHEXANE-1,6-DIOLA,D2NY40.74
HEZHEXANE-1,6-DIOLA1P2V0.74
HEZHEXANE-1,6-DIOLA1NHZ0.74
HEZHEXANE-1,6-DIOLA,C,D,E,F,G2HY60.74
HEZHEXANE-1,6-DIOLA2NXY0.74
HEZHEXANE-1,6-DIOLA,B2VYP0.74
HEZHEXANE-1,6-DIOLA,B1JMT0.74
HEZHEXANE-1,6-DIOLA1U3C0.74
HEZHEXANE-1,6-DIOLA,B,C,D3G360.74
HEZHEXANE-1,6-DIOLA,B,C,D3EDC0.74
HEZHEXANE-1,6-DIOLA1QUH0.74
HEZHEXANE-1,6-DIOLA1IN40.74
HEZHEXANE-1,6-DIOLA,B,C,D1WXW0.74
HEZHEXANE-1,6-DIOLA,B3EV10.74
HEZHEXANE-1,6-DIOLA,B,D2WIW0.74
HEZHEXANE-1,6-DIOLA,B,C,D1IBY0.74
HEZHEXANE-1,6-DIOLA1QUD0.74
HNB(2S,5R)-5-pentyltetrahydrofuran-
2-ol
A2K8T0.76
HNB(2S,5R)-5-pentyltetrahydrofuran-
2-ol
A2K8U0.76
F09NONAN-1-OLA,C2DWD0.84
F09NONAN-1-OLB,C1R3L0.84
F09NONAN-1-OLC,H1R3I0.84
F09NONAN-1-OLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V
1YCE0.84
F09NONAN-1-OLC2DWE0.84
F09NONAN-1-OLA,C2HVJ0.84
F09NONAN-1-OLB,C1R3J0.84
F09NONAN-1-OLC1K4D0.84
F09NONAN-1-OLA,C1K4C0.84
F09NONAN-1-OLC2ATK0.84
F09NONAN-1-OLA,C1ZWI0.84
F09NONAN-1-OLA1ZNK0.84
F09NONAN-1-OLB,C1S5H0.84
F09NONAN-1-OLA,C2HVK0.84
F09NONAN-1-OLA,C2P7T0.84