MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02633888

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
BEZ	BENZOIC ACID	A,B	2F8D	0.75
BEZ	BENZOIC ACID	A,B	1A8U	0.75
BEZ	BENZOIC ACID	A,B	1REE	0.75
BEZ	BENZOIC ACID	A	1L7Q	0.75
BEZ	BENZOIC ACID	A	1I69	0.75
BEZ	BENZOIC ACID	H,L	1RUL	0.75
BEZ	BENZOIC ACID	A,B	3CCF	0.75
BEZ	BENZOIC ACID	A	1W9Q	0.75
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.75
BEZ	BENZOIC ACID	H,L	1RUA	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.75
BEZ	BENZOIC ACID	H,L	1RU9	0.75
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.75
BEZ	BENZOIC ACID	A	2QMQ	0.75
BEZ	BENZOIC ACID	A	1UKB	0.75
BEZ	BENZOIC ACID	A,B	1RED	0.75
BEZ	BENZOIC ACID	A,B	1OC3	0.75
BEZ	BENZOIC ACID	A,B	1REF	0.75
BEZ	BENZOIC ACID	A,B	2O02	0.75
BEZ	BENZOIC ACID	A,B	2VJ1	0.75
BEZ	BENZOIC ACID	A,B,C	1WSP	0.75
BEZ	BENZOIC ACID	A	1HZ4	0.75
BEZ	BENZOIC ACID	A	2Q38	0.75
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.75
BEZ	BENZOIC ACID	A,B	2QL8	0.75
BEZ	BENZOIC ACID	A	2Q0I	0.75
BEZ	BENZOIC ACID	A,B	1S8F	0.75
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.75
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.75
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.75
BEZ	BENZOIC ACID	A,B	2F78	0.75
BEZ	BENZOIC ACID	A,B	2VL2	0.75
BEZ	BENZOIC ACID	A	1HD2	0.75
BEZ	BENZOIC ACID	A	1JU4	0.75
BEZ	BENZOIC ACID	H,L	2AJY	0.75
BEZ	BENZOIC ACID	A,B,C	3GV1	0.75
BEZ	BENZOIC ACID	A	2Q6U	0.75
BEZ	BENZOIC ACID	A,B	1VE9	0.75
BEZ	BENZOIC ACID	A,B	1S9A	0.75
BEZ	BENZOIC ACID	H,L,M	1OP3	0.75
BEZ	BENZOIC ACID	A	1W9E	0.75
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.75
BEZ	BENZOIC ACID	H,L	2AK1	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.75
BEZ	BENZOIC ACID	A,B	1GYX	0.75
BEZ	BENZOIC ACID	A	1V1T	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.75
BEZ	BENZOIC ACID	A,B	1HKQ	0.75
BEZ	BENZOIC ACID	H,L	1RUK	0.75
BEZ	BENZOIC ACID	A	2Q1B	0.75
BEZ	BENZOIC ACID	H,L	1RUM	0.75
BEZ	BENZOIC ACID	A,B	2F7A	0.75
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.75
BEZ	BENZOIC ACID	A,B	2V7B	0.75
BEZ	BENZOIC ACID	H	1NCW	0.75
BEZ	BENZOIC ACID	A,B	1TMX	0.75
BEZ	BENZOIC ACID	A	1URM	0.75
BEZ	BENZOIC ACID	A	1W9O	0.75
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.75
BEZ	BENZOIC ACID	H	1RUP	0.75
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.75
BEZ	BENZOIC ACID	A	2Q9R	0.75
BEZ	BENZOIC ACID	D,H	2OK6	0.75
BEZ	BENZOIC ACID	A,B	2Q0J	0.75
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.73
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.73
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.75
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.78
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.72
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.72
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
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.74
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.74
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.74
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.74
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.74
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.7
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.7
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.7
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.7
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.7
PMA	PYROMELLITIC ACID	A,B	1FUP	0.72
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.75
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.75
791	2-PHENYLMALONIC ACID	A	1O4P	0.7
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.71
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE	B	5UPJ	0.74
NOM	7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO- 1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE- 2,6,11-TRIONE	A	1N5V	0.71
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.74
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID	A	2IMF	0.72
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.72
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.74
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	0.77
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	0.77
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.74
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.74
PHT	PHTHALIC ACID	A,B,C	2B7P	0.8
PHT	PHTHALIC ACID	A	3C2V	0.8
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.8
PHT	PHTHALIC ACID	A,B	3C2R	0.8
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.73
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.72
C1E	(2Z,4E)-3-chloro-2-hydroxy-6-oxo- 6-phenylhexa-2,4-dienoic acid	A	2RHT	0.71
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.76
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.82
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.82
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.82
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.72
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.72
HPK	(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE	A	2PUH	0.74
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.7
TRZ	TRAZEOLIDE	A	1C12	0.72
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.73
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.74
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.73
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.73
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.71
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.71
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.71
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.75
FBC		A,B	2B9A	0.72
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.77
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.77
MBO	MERCURIBENZOIC ACID	A	2QO8	0.75
MBO	MERCURIBENZOIC ACID	A	1LUG	0.75
MBO	MERCURIBENZOIC ACID	A	2HOC	0.75
MBO	MERCURIBENZOIC ACID	A	3EFI	0.75
MBO	MERCURIBENZOIC ACID	A	3BL0	0.75
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.75
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.75
MBO	MERCURIBENZOIC ACID	A	1DR7	0.75
MBO	MERCURIBENZOIC ACID	A	2HL4	0.75
MBO	MERCURIBENZOIC ACID	A	2GD8	0.75
MBO	MERCURIBENZOIC ACID	A	2QP6	0.75
MBO	MERCURIBENZOIC ACID	A	2HD6	0.75
MBO	MERCURIBENZOIC ACID	A	3C7P	0.75
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.75
MBO	MERCURIBENZOIC ACID	A	1DR6	0.75
MBO	MERCURIBENZOIC ACID	A	2HNC	0.75
MBO	MERCURIBENZOIC ACID	A	2QOA	0.75
PAC	2-PHENYLACETIC ACID	B	1PNL	0.7
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.7
PAC	2-PHENYLACETIC ACID	B	1FXH	0.7
PAC	2-PHENYLACETIC ACID	A	2ISF	0.7
PAC	2-PHENYLACETIC ACID	A	2INE	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	0.71
DBF	DIBENZOFURAN-4,6-DICARBOXYLIC ACID	B	1DVU	0.72
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE	A	6UPJ	0.74
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
BZF	BENZOFURAN	A	182L	0.73
4FC		A	1YSG	0.73
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.81
CP5	(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}- 2-PHENYLACRYLATE	A	1SCW	0.71
HPX	(2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID	A,B,C,D	2DSA	0.72
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.74
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.74
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.77
26C		A,B	2F7I	0.72
HPZ	(2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID	A	2PUJ	0.72