MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02379518

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

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.73
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.73
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.73
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.73
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.74
MBO	MERCURIBENZOIC ACID	A	2QO8	0.76
MBO	MERCURIBENZOIC ACID	A	1LUG	0.76
MBO	MERCURIBENZOIC ACID	A	2HOC	0.76
MBO	MERCURIBENZOIC ACID	A	3EFI	0.76
MBO	MERCURIBENZOIC ACID	A	3BL0	0.76
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.76
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.76
MBO	MERCURIBENZOIC ACID	A	1DR7	0.76
MBO	MERCURIBENZOIC ACID	A	2HL4	0.76
MBO	MERCURIBENZOIC ACID	A	2GD8	0.76
MBO	MERCURIBENZOIC ACID	A	2QP6	0.76
MBO	MERCURIBENZOIC ACID	A	2HD6	0.76
MBO	MERCURIBENZOIC ACID	A	3C7P	0.76
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.76
MBO	MERCURIBENZOIC ACID	A	1DR6	0.76
MBO	MERCURIBENZOIC ACID	A	2HNC	0.76
MBO	MERCURIBENZOIC ACID	A	2QOA	0.76
PSN	BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4K	0.72
CP5	(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}- 2-PHENYLACRYLATE	A	1SCW	0.74
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.72
FLP	FLURBIPROFEN	A,B	1CQE	0.72
FLP	FLURBIPROFEN	A,B	1EQH	0.72
FLP	FLURBIPROFEN	A,B	2AYL	0.72
FLP	FLURBIPROFEN	A	1DVT	0.72
FLP	FLURBIPROFEN	A	1R9O	0.72
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.77
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.75
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.75
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.75
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.75
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.75
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.75
26C		A,B	2F7I	0.8
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.71
254	6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FD0	0.72
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A	1MVC	0.73
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A,C,E,G	1MZN	0.73
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.72
4FC		A	1YSG	0.81
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.72
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.71
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.77
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID	A,B	2BXE	0.72
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID	A,B	3D2T	0.72
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.7
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.78
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.7
FBC		A,B	2B9A	0.8
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.8
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.8
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.8
IBP	IBUPROFEN	A	3FKX	0.7
IBP	IBUPROFEN	A,B	2BXG	0.7
IBP	IBUPROFEN	A,B	1EQG	0.7
IBP	IBUPROFEN	A,B,C	2WD9	0.7
IBP	IBUPROFEN	A	2PWS	0.7
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.79
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.79
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.72
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.79
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.83
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.83
299	2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE	A	1O4E	0.71
OX1		H,Y	1LO2	0.71
I59	HYDROXY(1-NAPHTHYL)METHYLPHOSPHONIC ACID	A	1O4G	0.74
AN1	3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID	H,Y	1LO3	0.7
MUF	(8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid	A,B	3BEJ	0.73
789	3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE	A,B	1ZAF	0.7
PIC	6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE- 2-CARBOXYLIC ACID	A	1BZJ	0.85
PMA	PYROMELLITIC ACID	A,B	1FUP	0.76
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.73
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.74
ESO	O3-PHOSPHONOESTRONE	B,C	1ESS	0.72
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5A	0.72
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5C	0.72
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.74
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.74
PHT	PHTHALIC ACID	A,B,C	2B7P	0.78
PHT	PHTHALIC ACID	A	3C2V	0.78
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.78
PHT	PHTHALIC ACID	A,B	3C2R	0.78
219	CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4I	0.7
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.82
NLA	NAPHTHALEN-1-YL-ACETIC ACID	A,B,C,D	1LRH	0.74
NLA	NAPHTHALEN-1-YL-ACETIC ACID	B	2P1O	0.74
BFL		A,B	1Q4G	0.73
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.77
BEZ	BENZOIC ACID	A,B	2F8D	0.76
BEZ	BENZOIC ACID	A,B	1A8U	0.76
BEZ	BENZOIC ACID	A,B	1REE	0.76
BEZ	BENZOIC ACID	A	1L7Q	0.76
BEZ	BENZOIC ACID	A	1I69	0.76
BEZ	BENZOIC ACID	H,L	1RUL	0.76
BEZ	BENZOIC ACID	A,B	3CCF	0.76
BEZ	BENZOIC ACID	A	1W9Q	0.76
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.76
BEZ	BENZOIC ACID	H,L	1RUA	0.76
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.76
BEZ	BENZOIC ACID	H,L	1RU9	0.76
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.76
BEZ	BENZOIC ACID	A	2QMQ	0.76
BEZ	BENZOIC ACID	A	1UKB	0.76
BEZ	BENZOIC ACID	A,B	1RED	0.76
BEZ	BENZOIC ACID	A,B	1OC3	0.76
BEZ	BENZOIC ACID	A,B	1REF	0.76
BEZ	BENZOIC ACID	A,B	2O02	0.76
BEZ	BENZOIC ACID	A,B	2VJ1	0.76
BEZ	BENZOIC ACID	A,B,C	1WSP	0.76
BEZ	BENZOIC ACID	A	1HZ4	0.76
BEZ	BENZOIC ACID	A	2Q38	0.76
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.76
BEZ	BENZOIC ACID	A,B	2QL8	0.76
BEZ	BENZOIC ACID	A	2Q0I	0.76
BEZ	BENZOIC ACID	A,B	1S8F	0.76
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.76
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.76
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.76
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.76
BEZ	BENZOIC ACID	A,B	2F78	0.76
BEZ	BENZOIC ACID	A,B	2VL2	0.76
BEZ	BENZOIC ACID	A	1HD2	0.76
BEZ	BENZOIC ACID	A	1JU4	0.76
BEZ	BENZOIC ACID	H,L	2AJY	0.76
BEZ	BENZOIC ACID	A,B,C	3GV1	0.76
BEZ	BENZOIC ACID	A	2Q6U	0.76
BEZ	BENZOIC ACID	A,B	1VE9	0.76
BEZ	BENZOIC ACID	A,B	1S9A	0.76
BEZ	BENZOIC ACID	H,L,M	1OP3	0.76
BEZ	BENZOIC ACID	A	1W9E	0.76
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.76
BEZ	BENZOIC ACID	H,L	2AK1	0.76
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.76
BEZ	BENZOIC ACID	A,B	1GYX	0.76
BEZ	BENZOIC ACID	A	1V1T	0.76
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.76
BEZ	BENZOIC ACID	A,B	1HKQ	0.76
BEZ	BENZOIC ACID	H,L	1RUK	0.76
BEZ	BENZOIC ACID	A	2Q1B	0.76
BEZ	BENZOIC ACID	H,L	1RUM	0.76
BEZ	BENZOIC ACID	A,B	2F7A	0.76
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.76
BEZ	BENZOIC ACID	A,B	2V7B	0.76
BEZ	BENZOIC ACID	H	1NCW	0.76
BEZ	BENZOIC ACID	A,B	1TMX	0.76
BEZ	BENZOIC ACID	A	1URM	0.76
BEZ	BENZOIC ACID	A	1W9O	0.76
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.76
BEZ	BENZOIC ACID	H	1RUP	0.76
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.76
BEZ	BENZOIC ACID	A	2Q9R	0.76
BEZ	BENZOIC ACID	D,H	2OK6	0.76
BEZ	BENZOIC ACID	A,B	2Q0J	0.76
ADL	(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID	A,B	1N5S	0.71
OAL	(1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	B	1N5T	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.71
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.76
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.76
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.8
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.76
TRZ	TRAZEOLIDE	A	1C12	0.75
BJP	(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID	A	1ERO	0.71