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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03401145

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5646-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTALENE-2-CARBONYL)-
NAPHTALENE-2-CARBOXYLIC ACID		A1FCY0.72
DIC3,4-DICHLOROISOCOUMARINA1DIC0.74
1NH(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]-
3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE		B1O1S0.78
BZSL-BENZYLSUCCINIC ACIDA1CBX0.71
BZSL-BENZYLSUCCINIC ACIDA1HYT0.71
BZSL-BENZYLSUCCINIC ACIDA,B1WHT0.71
1846-[HYDROXY-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTALEN-2-
YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID		A1FCX0.73
BHCBENZENE HEXACARBOXYLIC ACIDA,B,C,D1BQ40.77
BEZBENZOIC ACIDA,B2F8D0.72
BEZBENZOIC ACIDA,B1A8U0.72
BEZBENZOIC ACIDA,B1REE0.72
BEZBENZOIC ACIDA1L7Q0.72
BEZBENZOIC ACIDA1I690.72
BEZBENZOIC ACIDH,L1RUL0.72
BEZBENZOIC ACIDA,B3CCF0.72
BEZBENZOIC ACIDA1W9Q0.72
BEZBENZOIC ACIDA,B,G,J2DU80.72
BEZBENZOIC ACIDH,L1RUA0.72
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		1H4O0.72
BEZBENZOIC ACIDH,L1RU90.72
BEZBENZOIC ACIDA,B,C,D2V320.72
BEZBENZOIC ACIDA2QMQ0.72
BEZBENZOIC ACIDA1UKB0.72
BEZBENZOIC ACIDA,B1RED0.72
BEZBENZOIC ACIDA,B1OC30.72
BEZBENZOIC ACIDA,B1REF0.72
BEZBENZOIC ACIDA,B2O020.72
BEZBENZOIC ACIDA,B2VJ10.72
BEZBENZOIC ACIDA,B,C1WSP0.72
BEZBENZOIC ACIDA1HZ40.72
BEZBENZOIC ACIDA2Q380.72
BEZBENZOIC ACIDA,B,C,D1UUJ0.72
BEZBENZOIC ACIDA,B2QL80.72
BEZBENZOIC ACIDA2Q0I0.72
BEZBENZOIC ACIDA,B1S8F0.72
BEZBENZOIC ACIDD,E,F,G,H1DJR0.72
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H,I		1ONI0.72
BEZBENZOIC ACIDA,B,C,D1I7Q0.72
BEZBENZOIC ACIDA,B,C,D2RHM0.72
BEZBENZOIC ACIDA,B2F780.72
BEZBENZOIC ACIDA,B2VL20.72
BEZBENZOIC ACIDA1HD20.72
BEZBENZOIC ACIDA1JU40.72
BEZBENZOIC ACIDH,L2AJY0.72
BEZBENZOIC ACIDA,B,C3GV10.72
BEZBENZOIC ACIDA2Q6U0.72
BEZBENZOIC ACIDA,B1VE90.72
BEZBENZOIC ACIDA,B1S9A0.72
BEZBENZOIC ACIDH,L,M1OP30.72
BEZBENZOIC ACIDA1W9E0.72
BEZBENZOIC ACIDA,B,C,D2V2G0.72
BEZBENZOIC ACIDH,L2AK10.72
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		2V410.72
BEZBENZOIC ACIDA,B1GYX0.72
BEZBENZOIC ACIDA1V1T0.72
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1YAJ0.72
BEZBENZOIC ACIDA,B1HKQ0.72
BEZBENZOIC ACIDH,L1RUK0.72
BEZBENZOIC ACIDA2Q1B0.72
BEZBENZOIC ACIDH,L1RUM0.72
BEZBENZOIC ACIDA,B2F7A0.72
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		1KIF0.72
BEZBENZOIC ACIDA,B2V7B0.72
BEZBENZOIC ACIDH1NCW0.72
BEZBENZOIC ACIDA,B1TMX0.72
BEZBENZOIC ACIDA1URM0.72
BEZBENZOIC ACIDA1W9O0.72
BEZBENZOIC ACIDA,B,C,D1GXS0.72
BEZBENZOIC ACIDH1RUP0.72
BEZBENZOIC ACIDA,B,C,D1KQB0.72
BEZBENZOIC ACIDA2Q9R0.72
BEZBENZOIC ACIDD,H2OK60.72
BEZBENZOIC ACIDA,B2Q0J0.72
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID		A1FCZ0.75
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE		A,B,C,D2F990.71
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.73
AI73-(heptyloxy)benzoic acidA,B2O3Z0.75
26CA,B2F7I0.74
CIN4-CARBOXYCINNAMIC ACIDA,B,C,D1HAB0.77
CIN4-CARBOXYCINNAMIC ACIDA,B1T6J0.77
4FCA1YSG0.74
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFK0.71
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFQ0.71
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1Z9Y0.71
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZH90.71
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGE0.71
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGF0.71
BZMBENZOIC ACID PHENYLMETHYLESTERA,B1DZM0.81
ANN4-METHOXYBENZOIC ACIDA2B960.71
ANN4-METHOXYBENZOIC ACIDA2QUE0.71
ANN4-METHOXYBENZOIC ACIDA1SV30.71
ANN4-METHOXYBENZOIC ACIDA1O2E0.71
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.71
BM64-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN-
2-YL]-BENZOIC ACID		A1MVC0.81
BM64-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN-
2-YL]-BENZOIC ACID		A,C,E,G1MZN0.81
4MA4-METHYLBENZOIC ACIDA,H2HRG0.77