MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00122145

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
B23	5-(2-NITROPHENYL)-2-FUROIC ACID	A	2Q92	0.8
HAB		A,B	1SRE	0.73
IX1	5-(3-{3-[3-HYDROXY-2-(METHOXYCARBONYL)PHENOXY]PROPENYL}PHENYL)- 4-(HYDROXYMETHYL)ISOXAZOLE-3-CARBOXYLIC ACID	A	1XBO	0.71
MNX	1,8-DI-HYDROXY-4-NITRO-XANTHEN- 9-ONE	A	1M2Q	0.73
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,C,D,I,J, K,L	3EWF	0.72
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	A,B,I,L	2V5W	0.72
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	B	1VDN	0.72
MCM	7-AMINO-4-METHYL-CHROMEN-2-ONE	C	1VAI	0.72
194	4-{2-[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACID	A	1Z6P	0.74
44C		A	2FBR	0.8
RQ3	2-{4-[(3,5-DIMETHYLANILINO)-CARBONYL- METHYL]-PHENOXY}-2-METHYLPROPIONIC ACID	A,B,C,D	1G9V	0.71
R36	4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)- ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL- 5-PHENYL-PENTYL}-BENZAMIDE	A	1LEE	0.7
ACJ	5-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENOXY]- 2-NITROBENZOIC ACID	A,B	2IVD	0.77
O62	6-(4-{[3-(2,6-dichlorophenyl)-5- (1-methylethyl)isoxazol-4-yl]methoxy}phenyl)naphthalene- 1-carboxylic acid	A	3DCU	0.73
DMB		A,B	1SRI	0.74
NAB		A,B	1SRJ	0.74
234	5-{2-FLUORO-5-[3-(3-HYDROXY-2-METHOXYCARBONYL- PHENOXY)-PROPENYL]-PHENYL}-ISOXAZOLE- 3-CARBOXYLIC ACID	A	1Q1M	0.72
323	2-[3,6-bis(dimethylamino)xanthen- 9-yl]-5-methanoyl-benzoate	A,P,Q	3D1F	0.73
6CA		A	2FLM	0.8
R2C	5-METHOXY-2-[(4-PHENOXYPHENYL)AMINO]BENZOIC ACID	A	2PRL	0.78
NRO	3-[5-(2-nitropent-1-en-1-yl)furan- 2-yl]benzoic acid	A,B	2ZK5	0.75
MTB		A,B	1SRF	0.76
RHQ	RHODAMINE 6G	A,B,D,E	1JUS	0.72
RHQ	RHODAMINE 6G	A,B,D,E	3BR5	0.72
RHQ	RHODAMINE 6G	A,D,E	3BR6	0.72
RHQ	RHODAMINE 6G	A,B	3D6Z	0.72
RHQ	RHODAMINE 6G	A	1OY8	0.72
RHQ	RHODAMINE 6G	A	1T9V	0.72
MR2	3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE	A	1TSM	0.77
MHB		A,B	1SRG	0.73
MOB		A,B	1SRH	0.71
RHO	TETRAMETHYLRHODAMINE-5-MALEIMIDE	A	1J6Z	0.71
RHO	TETRAMETHYLRHODAMINE-5-MALEIMIDE	A	1NWK	0.71
064	3-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)- 5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid	A	3DCT	0.74
FMX	FAMOXADONE	C,D,E	1L0L	0.7
HNA	1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE	A	1M2P	0.74
9AR	9-HYDROXY ARISTOLOCHIC ACID	A,B	1FV0	0.74
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.71
195	4-{2,4-BIS[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACID	A	1Z6Q	0.71
R6G	RHODAMINE 6G	B	2V3L	0.7
D27	2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid	A,B,C,D	2VD0	0.74