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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02408193

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CAK[(1R,2R,3S,4S,5R)-2,3,4,5-TETRAHYDROXYCYCLOHEXYL]METHYL DIHYDROGEN PHOSPHATEA,B2GRU0.72
MQD2-METHYLPENTANE-1,2,4-TRIOLA,B1OAD0.73
5HD5-(2-hydroxyethyl)nonane-1,9-diolA3DWB0.73
YLL(1R,2S,3S,4S,5R,6R)-6-(HYDROXYMETHYL)CYCLOHEXANE-
1,2,3,4,5-PENTOL
A,B2JAL0.84
HTOHEPTANE-1,2,3-TRIOLH,L,M2HH10.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWT0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXK0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M1RZH0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2HG30.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX30.73
HTOHEPTANE-1,2,3-TRIOLA2PIL0.73
HTOHEPTANE-1,2,3-TRIOLA,B1U190.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8D0.73
HTOHEPTANE-1,2,3-TRIOLA,B,C,D3DTU0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX40.73
HTOHEPTANE-1,2,3-TRIOLA,B1HZX0.73
HTOHEPTANE-1,2,3-TRIOLA,B2G870.73
HTOHEPTANE-1,2,3-TRIOLA,B2PED0.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M3D380.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWV0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M1RG50.73
HTOHEPTANE-1,2,3-TRIOLA1KMO0.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M1L9B0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWU0.73
HTOHEPTANE-1,2,3-TRIOLA1AY20.73
HTOHEPTANE-1,2,3-TRIOLA,B1RP00.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M2I5N0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8C0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2HJ60.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXJ0.73
HTOHEPTANE-1,2,3-TRIOLL,M1YF60.73
HTOHEPTANE-1,2,3-TRIOLB2BF30.73
HTOHEPTANE-1,2,3-TRIOLA,B2HPY0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX50.73
HTOHEPTANE-1,2,3-TRIOLL,M,X2UXM0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXL0.73
HTOHEPTANE-1,2,3-TRIOLA,B1L9H0.73
HTOHEPTANE-1,2,3-TRIOLA2HI20.73
HTOHEPTANE-1,2,3-TRIOLA,B,D,E,G,H,
J,K
1LGH0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWW0.73
CXLCYCLOHEXANOLA,B1HDX0.7