MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00003294

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
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.85
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.85
BHC	BENZENE HEXACARBOXYLIC ACID	A,B,C,D	1BQ4	0.84
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.76
4FC		A	1YSG	0.76
FHB	3-FLUORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCF	0.73
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.71
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.71
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3GT4	0.72
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3T	0.72
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3D	0.72
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E3S	0.72
I3C	5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid	A	3E79	0.72
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.77
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.77
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.77
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.77
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.77
BEZ	BENZOIC ACID	A,B	2F8D	0.77
BEZ	BENZOIC ACID	A,B	1A8U	0.77
BEZ	BENZOIC ACID	A,B	1REE	0.77
BEZ	BENZOIC ACID	A	1L7Q	0.77
BEZ	BENZOIC ACID	A	1I69	0.77
BEZ	BENZOIC ACID	H,L	1RUL	0.77
BEZ	BENZOIC ACID	A,B	3CCF	0.77
BEZ	BENZOIC ACID	A	1W9Q	0.77
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.77
BEZ	BENZOIC ACID	H,L	1RUA	0.77
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.77
BEZ	BENZOIC ACID	H,L	1RU9	0.77
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.77
BEZ	BENZOIC ACID	A	2QMQ	0.77
BEZ	BENZOIC ACID	A	1UKB	0.77
BEZ	BENZOIC ACID	A,B	1RED	0.77
BEZ	BENZOIC ACID	A,B	1OC3	0.77
BEZ	BENZOIC ACID	A,B	1REF	0.77
BEZ	BENZOIC ACID	A,B	2O02	0.77
BEZ	BENZOIC ACID	A,B	2VJ1	0.77
BEZ	BENZOIC ACID	A,B,C	1WSP	0.77
BEZ	BENZOIC ACID	A	1HZ4	0.77
BEZ	BENZOIC ACID	A	2Q38	0.77
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.77
BEZ	BENZOIC ACID	A,B	2QL8	0.77
BEZ	BENZOIC ACID	A	2Q0I	0.77
BEZ	BENZOIC ACID	A,B	1S8F	0.77
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.77
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.77
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.77
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.77
BEZ	BENZOIC ACID	A,B	2F78	0.77
BEZ	BENZOIC ACID	A,B	2VL2	0.77
BEZ	BENZOIC ACID	A	1HD2	0.77
BEZ	BENZOIC ACID	A	1JU4	0.77
BEZ	BENZOIC ACID	H,L	2AJY	0.77
BEZ	BENZOIC ACID	A,B,C	3GV1	0.77
BEZ	BENZOIC ACID	A	2Q6U	0.77
BEZ	BENZOIC ACID	A,B	1VE9	0.77
BEZ	BENZOIC ACID	A,B	1S9A	0.77
BEZ	BENZOIC ACID	H,L,M	1OP3	0.77
BEZ	BENZOIC ACID	A	1W9E	0.77
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.77
BEZ	BENZOIC ACID	H,L	2AK1	0.77
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.77
BEZ	BENZOIC ACID	A,B	1GYX	0.77
BEZ	BENZOIC ACID	A	1V1T	0.77
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.77
BEZ	BENZOIC ACID	A,B	1HKQ	0.77
BEZ	BENZOIC ACID	H,L	1RUK	0.77
BEZ	BENZOIC ACID	A	2Q1B	0.77
BEZ	BENZOIC ACID	H,L	1RUM	0.77
BEZ	BENZOIC ACID	A,B	2F7A	0.77
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.77
BEZ	BENZOIC ACID	A,B	2V7B	0.77
BEZ	BENZOIC ACID	H	1NCW	0.77
BEZ	BENZOIC ACID	A,B	1TMX	0.77
BEZ	BENZOIC ACID	A	1URM	0.77
BEZ	BENZOIC ACID	A	1W9O	0.77
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.77
BEZ	BENZOIC ACID	H	1RUP	0.77
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.77
BEZ	BENZOIC ACID	A	2Q9R	0.77
BEZ	BENZOIC ACID	D,H	2OK6	0.77
BEZ	BENZOIC ACID	A,B	2Q0J	0.77
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.75
FBC		A,B	2B9A	0.77
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.72
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.72
MBO	MERCURIBENZOIC ACID	A	2QO8	0.77
MBO	MERCURIBENZOIC ACID	A	1LUG	0.77
MBO	MERCURIBENZOIC ACID	A	2HOC	0.77
MBO	MERCURIBENZOIC ACID	A	3EFI	0.77
MBO	MERCURIBENZOIC ACID	A	3BL0	0.77
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.77
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.77
MBO	MERCURIBENZOIC ACID	A	1DR7	0.77
MBO	MERCURIBENZOIC ACID	A	2HL4	0.77
MBO	MERCURIBENZOIC ACID	A	2GD8	0.77
MBO	MERCURIBENZOIC ACID	A	2QP6	0.77
MBO	MERCURIBENZOIC ACID	A	2HD6	0.77
MBO	MERCURIBENZOIC ACID	A	3C7P	0.77
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.77
MBO	MERCURIBENZOIC ACID	A	1DR6	0.77
MBO	MERCURIBENZOIC ACID	A	2HNC	0.77
MBO	MERCURIBENZOIC ACID	A	2QOA	0.77
PMA	PYROMELLITIC ACID	A,B	1FUP	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.7
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.7
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.7
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.7
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.7
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.77
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.77
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.76
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.76
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.76
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.76
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.76
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.76
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.73
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.73
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.73
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.78
26C		A,B	2F7I	0.77
PHT	PHTHALIC ACID	A,B,C	2B7P	0.75
PHT	PHTHALIC ACID	A	3C2V	0.75
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.75
PHT	PHTHALIC ACID	A,B	3C2R	0.75