MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02252863

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
PHQ	FORMIC ACID BENZYL ESTER	A,I	2F4O	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KJO	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2CDR	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2C1E	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	5PAD	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,F	1JXQ	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	2CNO	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,B	1CGL	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ9	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2C2K	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,I	2CNL	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KJP	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2C2M	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2AZB	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	9HVP	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1ESB	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,F	1DY8	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,I	1PPM	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	1GEC	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KS7	0.7
PHQ	FORMIC ACID BENZYL ESTER	C	1A8G	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KKK	0.7
PHQ	FORMIC ACID BENZYL ESTER	T,U,V,W,X,Y	1QDU	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,I	4TMN	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,I	5TMN	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KTO	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,C	1TG1	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ8	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,B	2G58	0.7
PHQ	FORMIC ACID BENZYL ESTER	Q,R,S,T,U,V	1F9E	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2CJY	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,I	1E8M	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KR6	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,I	6TMN	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KRO	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2CNN	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2C2O	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,B	1SQZ	0.7
PHQ	FORMIC ACID BENZYL ESTER	A,B	1THE	0.7
PHQ	FORMIC ACID BENZYL ESTER	I,J	2AZC	0.7
PHQ	FORMIC ACID BENZYL ESTER	E,I	5EST	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	2CNK	0.7
PHQ	FORMIC ACID BENZYL ESTER	A	1KL6	0.7
PHQ	FORMIC ACID BENZYL ESTER	I	6PAD	0.7
PHQ	FORMIC ACID BENZYL ESTER	B,I	2C2Z	0.7
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.75
BEZ	BENZOIC ACID	A,B	2F8D	0.73
BEZ	BENZOIC ACID	A,B	1A8U	0.73
BEZ	BENZOIC ACID	A,B	1REE	0.73
BEZ	BENZOIC ACID	A	1L7Q	0.73
BEZ	BENZOIC ACID	A	1I69	0.73
BEZ	BENZOIC ACID	H,L	1RUL	0.73
BEZ	BENZOIC ACID	A,B	3CCF	0.73
BEZ	BENZOIC ACID	A	1W9Q	0.73
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.73
BEZ	BENZOIC ACID	H,L	1RUA	0.73
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1H4O	0.73
BEZ	BENZOIC ACID	H,L	1RU9	0.73
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.73
BEZ	BENZOIC ACID	A	2QMQ	0.73
BEZ	BENZOIC ACID	A	1UKB	0.73
BEZ	BENZOIC ACID	A,B	1RED	0.73
BEZ	BENZOIC ACID	A,B	1OC3	0.73
BEZ	BENZOIC ACID	A,B	1REF	0.73
BEZ	BENZOIC ACID	A,B	2O02	0.73
BEZ	BENZOIC ACID	A,B	2VJ1	0.73
BEZ	BENZOIC ACID	A,B,C	1WSP	0.73
BEZ	BENZOIC ACID	A	1HZ4	0.73
BEZ	BENZOIC ACID	A	2Q38	0.73
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.73
BEZ	BENZOIC ACID	A,B	2QL8	0.73
BEZ	BENZOIC ACID	A	2Q0I	0.73
BEZ	BENZOIC ACID	A,B	1S8F	0.73
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.73
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I	1ONI	0.73
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.73
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.73
BEZ	BENZOIC ACID	A,B	2F78	0.73
BEZ	BENZOIC ACID	A,B	2VL2	0.73
BEZ	BENZOIC ACID	A	1HD2	0.73
BEZ	BENZOIC ACID	A	1JU4	0.73
BEZ	BENZOIC ACID	H,L	2AJY	0.73
BEZ	BENZOIC ACID	A,B,C	3GV1	0.73
BEZ	BENZOIC ACID	A	2Q6U	0.73
BEZ	BENZOIC ACID	A,B	1VE9	0.73
BEZ	BENZOIC ACID	A,B	1S9A	0.73
BEZ	BENZOIC ACID	H,L,M	1OP3	0.73
BEZ	BENZOIC ACID	A	1W9E	0.73
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.73
BEZ	BENZOIC ACID	H,L	2AK1	0.73
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	2V41	0.73
BEZ	BENZOIC ACID	A,B	1GYX	0.73
BEZ	BENZOIC ACID	A	1V1T	0.73
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1YAJ	0.73
BEZ	BENZOIC ACID	A,B	1HKQ	0.73
BEZ	BENZOIC ACID	H,L	1RUK	0.73
BEZ	BENZOIC ACID	A	2Q1B	0.73
BEZ	BENZOIC ACID	H,L	1RUM	0.73
BEZ	BENZOIC ACID	A,B	2F7A	0.73
BEZ	BENZOIC ACID	A,B,C,D,E,F, G,H	1KIF	0.73
BEZ	BENZOIC ACID	A,B	2V7B	0.73
BEZ	BENZOIC ACID	H	1NCW	0.73
BEZ	BENZOIC ACID	A,B	1TMX	0.73
BEZ	BENZOIC ACID	A	1URM	0.73
BEZ	BENZOIC ACID	A	1W9O	0.73
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.73
BEZ	BENZOIC ACID	H	1RUP	0.73
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.73
BEZ	BENZOIC ACID	A	2Q9R	0.73
BEZ	BENZOIC ACID	D,H	2OK6	0.73
BEZ	BENZOIC ACID	A,B	2Q0J	0.73
3BZ	3-chlorobenzoate	X	2QVZ	0.7
3BZ	3-chlorobenzoate	X	2QVX	0.7
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.74
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.74
174	4-CHLORO-BENZOIC ACID	X	3DLP	0.7
174	4-CHLORO-BENZOIC ACID	X	1T5D	0.7
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.73
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.73
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.73
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.73
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.73
54D	methyl thiophene-2-carboxylate	C	3D6B	0.7
M29	ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE	A	2NNV	0.71
M29	ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE	A,B	2NN7	0.71
ISF		A,B	1PGE	0.7
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.81
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.81
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.82
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.71
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.75
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.73
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.73
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.73
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.71
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.71
FC1	THIOCOUMARIN	A	2BHJ	0.7
MBO	MERCURIBENZOIC ACID	A	2QO8	0.73
MBO	MERCURIBENZOIC ACID	A	1LUG	0.73
MBO	MERCURIBENZOIC ACID	A	2HOC	0.73
MBO	MERCURIBENZOIC ACID	A	3EFI	0.73
MBO	MERCURIBENZOIC ACID	A	3BL0	0.73
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.73
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.73
MBO	MERCURIBENZOIC ACID	A	1DR7	0.73
MBO	MERCURIBENZOIC ACID	A	2HL4	0.73
MBO	MERCURIBENZOIC ACID	A	2GD8	0.73
MBO	MERCURIBENZOIC ACID	A	2QP6	0.73
MBO	MERCURIBENZOIC ACID	A	2HD6	0.73
MBO	MERCURIBENZOIC ACID	A	3C7P	0.73
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.73
MBO	MERCURIBENZOIC ACID	A	1DR6	0.73
MBO	MERCURIBENZOIC ACID	A	2HNC	0.73
MBO	MERCURIBENZOIC ACID	A	2QOA	0.73
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.7