MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02788944

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
3CC	N-[(2R)-5-(aminosulfonyl)-2,3-dihydro- 1H-inden-2-yl]-2-propylpentanamide	A	2QO8	0.71
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.79
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.79
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.79
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.79
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.76
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.76
SKF	1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE	A,B	1HNN	0.74
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.71
NAS	2-NAPHTHALENESULFONIC ACID	I	1QUR	0.71
NAS	2-NAPHTHALENESULFONIC ACID	E,I	1PPC	0.71
NAS	2-NAPHTHALENESULFONIC ACID	H	1ETS	0.71
HS4	N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide	A	3F17	0.75
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE	A,B,C,D	1TP7	0.76
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.7
TOS	P-SULFINOTOLUENE	H	1ETT	0.74
TOS	P-SULFINOTOLUENE	I	4PAD	0.74
TOS	P-SULFINOTOLUENE	A	1EST	0.74
TOS	P-SULFINOTOLUENE	C,G	2CHA	0.74
TOS	P-SULFINOTOLUENE	E	1PPH	0.74
BPS		A,B	2DE4	0.73
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A,B	2NMX	0.78
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A	2NNS	0.78
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.83
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.83
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D73	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D77	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D78	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3CZ1	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D75	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D76	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3BJH	0.75
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D74	0.75
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.75
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.75
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.75
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.75
NDT	2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ- 1-OL	A,B	1DFG	0.71
JT5	N~2~-(biphenyl-4-ylsulfonyl)-N- hydroxy-N~2~-(2-hydroxyethyl)glycinamide	A	2JT5	0.71
DPK	DEPRENYL	A,B	2BYB	0.7
MAJ	indane-5-sulfonamide	A	2QOA	0.79
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.81
FTS	(3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE	A,B	2G71	0.7