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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03674808

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHASALICYLHYDROXAMIC ACIDX1V0H0.87
SHASALICYLHYDROXAMIC ACIDA2QPK0.87
SHASALICYLHYDROXAMIC ACIDA3FNL0.87
SHASALICYLHYDROXAMIC ACIDA3GCJ0.87
SHASALICYLHYDROXAMIC ACIDA1CK60.87
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.84
DB12,3-DIHYDROXYBENZAMIDEA,B,C1X710.83
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.82
1BA4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDEA2GPP0.79
SAL2-HYDROXYBENZOIC ACIDA2I2Z0.75
SAL2-HYDROXYBENZOIC ACIDA,B,C1FIQ0.75
SAL2-HYDROXYBENZOIC ACIDA2I300.75
SAL2-HYDROXYBENZOIC ACIDA,B1PTH0.75
SAL2-HYDROXYBENZOIC ACIDA,B3DEU0.75
SAL2-HYDROXYBENZOIC ACIDA,B,C,D2E1Q0.75
SAL2-HYDROXYBENZOIC ACIDA,B3HGX0.75
SAL2-HYDROXYBENZOIC ACIDA,B3BPX0.75
SAL2-HYDROXYBENZOIC ACIDA1WYG0.75
SAL2-HYDROXYBENZOIC ACIDA1JGS0.75
SAL2-HYDROXYBENZOIC ACIDX1M6E0.75
SAL2-HYDROXYBENZOIC ACIDA3B9M0.75
SAL2-HYDROXYBENZOIC ACIDA,B1FO40.75
SAL2-HYDROXYBENZOIC ACIDA,B1Y7I0.75
SAL2-HYDROXYBENZOIC ACIDA,B2FN10.75
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.75
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.75
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBC0.74
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBF0.74
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1SXK0.74
IFBN-[(2',4'-DIFLUORO-4-HYDROXY-5-
IODOBIPHENYL-3-YL)CARBONYL]-BETA-
ALANINE
A,B3FCB0.73
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.73
TYCL-TYROSINAMIDEA2BF90.73
TYCL-TYROSINAMIDEA2OCI0.73
BFSN-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDEA1STD0.73
BFSN-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDEA,B,C4STD0.73
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B2BXE0.72
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B3D2T0.72
BJH1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-
HYDROXYPHENYL)ETHYL BORONIC ACID
A1ERQ0.72
3MB3-METHOXYBENZAMIDEA3PAX0.72
JUG5-hydroxynaphthalene-1,4-dioneA,B,C,D,E,F3B7J0.71
IFAA,B3FC80.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
DIU2-HYDROXY-3,5-DIIODO-BENZOIC ACIDA,B3B560.71
DIU2-HYDROXY-3,5-DIIODO-BENZOIC ACIDA2BXL0.71
FHB3-FLUORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCF0.71
135N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY-
BENZAMIDE
B1GJA0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
3HA3-HYDROXYANTHRANILIC ACIDA,B1U1W0.71
3HA3-HYDROXYANTHRANILIC ACIDA1YFY0.71
3XH3-Hydroxyhippuric acidA3E9K0.71
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.71
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.71
23A2,3-DIHYDROXYBENZALDEHYDEA,B,C,D2DVX0.71
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.7
3HB3-HYDROXYBENZOIC ACIDA2DKH0.7
AC6P-HYDROXYACETOPHENONEA2GQ80.7
AC6P-HYDROXYACETOPHENONEX2O480.7
HABA,B1SRE0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOD0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOE0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1PBB0.7
ECAN,N',N''-[BENZENE-1,3,5-TRIYLTRIS(METHYLENE)]TRIS(2,3-
DIHYDROXYBENZAMIDE)
A,B2CHU0.7
MHBA,B1SRG0.7
3BE3-bromo-N'-[(1E)-(3,5-dibromo-2,4-
dihydroxyphenyl)methylidene]benzohydrazide
A,B,C,D,E,F3DOZ0.7