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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02690721

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.7
4MDN-(4-chlorobenzyl)-N-methylbenzene-
1,4-disulfonamide
A,B3DA20.7
34A3,4-DIMETHYLANILINEA1L4K0.74
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.72
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.74
XYD2,5-DIMETHYLANILINEA1L4L0.74
SANSULFANILAMIDEA1AJ00.72
ISOPARA-ISOPROPYLANILINEA1BMA0.74
ISOPARA-ISOPROPYLANILINEA,B1ELC0.74
ISOPARA-ISOPROPYLANILINEA,B1ELB0.74
ISOPARA-ISOPROPYLANILINEA,B1ELA0.74
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.79
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.7
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.78
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.7
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.75
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.7
PRY2-PROPYL-ANILINEA1OWY0.74
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.73
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.71
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.71
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.72
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.71
TMJN-(4-CHLOROPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-
7-SULFONAMIDE
A,B2ONY0.73
TMJN-(4-CHLOROPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-
7-SULFONAMIDE
A,B2ONZ0.73