MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02365213

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
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.87
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.83
APZ	4-AMINOPHTHALHYDRAZIDE	A	1ENU	0.78
34A	3,4-DIMETHYLANILINE	A	1L4K	0.77
IBR		A	9EST	0.77
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.77
ISN	ISATIN	A,B	1OJA	0.76
ISN	ISATIN	A,B	2BK5	0.76
4PG	1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine	U	2R2W	0.76
12B	BENZO[CD]INDOL-2(1H)-ONE	A,B	2F67	0.75
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.75
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.74
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.74
TSN	TRICHOSTATIN A	A,B	1T64	0.74
TSN	TRICHOSTATIN A	A,B	1C3R	0.74
TSN	TRICHOSTATIN A	A,B,C	3F0R	0.74
TSN	TRICHOSTATIN A	A,B,C	3C10	0.74
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.74
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.74
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.74
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.74
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.74
DPZ	3,5-DIAMINOPHTHALHYDRAZIDE	A	1F3E	0.73
PRY	2-PROPYL-ANILINE	A	1OWY	0.73
HBC	(2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE	H	1JGU	0.73
TTT	5-amino-2-methyl-N-[(1R)-1-naphthalen- 1-ylethyl]benzamide	A	3E9S	0.73
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.72
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.72
4AN	6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE	A	2PAX	0.72
KYN	KYNURENINE	A,B,C,D	2R2N	0.72
KYN	KYNURENINE	A,B	3E2Z	0.72
KYN	KYNURENINE	A	1XT7	0.72
KYN	KYNURENINE	A	1T5M	0.72
KYN	KYNURENINE	A	1T5N	0.72
KYN	KYNURENINE	A	2VOV	0.72
KYN	KYNURENINE	A	2VOX	0.72
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.71
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.71
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.71
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.71
BVA	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE	B,C	2P8O	0.7
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.7
BHO	BENZHYDROXAMIC ACID	A,B	1GX2	0.7
BHO	BENZHYDROXAMIC ACID	A	1HSR	0.7
BHO	BENZHYDROXAMIC ACID	A,B	2ATJ	0.7
BHO	BENZHYDROXAMIC ACID	A,B	4ATJ	0.7
BHO	BENZHYDROXAMIC ACID	A,B	3ATJ	0.7
BHO	BENZHYDROXAMIC ACID	A	3GCK	0.7
BHO	BENZHYDROXAMIC ACID	A,B,C,D,E,F, G,H	2BOY	0.7
C16	4-(4-methyl-1,3-dioxo-1,3-dihydro- 2H-isoindol-2-yl)benzonitrile	A	3BNZ	0.7