MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00000677

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
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.73
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.73
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.77
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.77
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.73
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.71
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.7
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.72
ABN	BENZYLAMINE	D,H	2HXC	0.74
ABN	BENZYLAMINE	A,I	1A86	0.74
ABN	BENZYLAMINE	A	1UTN	0.74
ABN	BENZYLAMINE	A	1N6X	0.74
ABN	BENZYLAMINE	A	2BZA	0.74
ABN	BENZYLAMINE	A	2EUS	0.74
ABN	BENZYLAMINE	A	1N6Y	0.74
ABN	BENZYLAMINE	A	1UTJ	0.74
008	(S)-2-[(R)-3-AMINO-4-(2-FLUORO- PHENYL)-BUTYRYL]-1,2,3,4-TETRAHYDRO- ISOQUINOLINE-3-CARBOXYLIC ACID AMIDE	A,B,C,D	2BUC	0.7
872	(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]- 3-(2,2,2-TRIFLUOROETHYL)-1,4-DIAZEPAN- 2-ONE	A,B	2IIT	0.71
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.7
APE	(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID	E,I	1SCN	0.73
37U	D-phenylalanyl-N-(3-fluorobenzyl)- L-prolinamide	H,I	2ZDV	0.72
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.76
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.75
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.92
271	N-methyl-1-phenylmethanamine	X	2RBT	0.78
565	(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]- 3-METHYL-1,4-DIAZEPAN-2-ONE	A,B	2IIV	0.72