MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03215464

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
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.85
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.85
ANL	ANILINE	A	2OV4	0.72
ANL	ANILINE	A	1AEE	0.72
ANL	ANILINE	A	1PPA	0.72
ANL	ANILINE	A	1HJ9	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.73
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.73
ANC	ANTHRACEN-1-YLAMINE	A,B	1GT1	0.77
ANC	ANTHRACEN-1-YLAMINE	A,B	1HN2	0.77
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.73
BRN	BERENIL	A,B	268D	0.76
BRN	BERENIL	A,B	1D63	0.76
BRN	BERENIL	A,D,E	2GBY	0.76
BRN	BERENIL	A	2DBE	0.76
BRN	BERENIL	A	2GVR	0.76
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.7
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.7
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.84
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.74
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.74
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.74
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.74
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.74
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.74
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.74
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.71
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.7
U12	5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE	A	2GG2	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.81
PRY	2-PROPYL-ANILINE	A	1OWY	0.84
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.73
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.71
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.81
9AP	9-AMINOPHENANTHRENE	A	1EGY	0.76
2CM	2-CHLORO-6-METHYL-ANILINE	A	1OVH	0.71
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.75
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.76
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.73
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.72
34A	3,4-DIMETHYLANILINE	A	1L4K	0.81
3NT	3-NITROTOLUENE	A,B	2BMR	0.71
3NT	3-NITROTOLUENE	A,B	2HMO	0.71
U19	5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE	A	2GG5	0.74
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.79
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.79
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.79
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.79