MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02170295

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
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.73
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.73
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.73
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.74
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.74
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.72
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.72
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.72
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.72
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.72
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.72
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.72
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.7
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.72
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.78
1MR	N-METHYLANILINE	X	2OTZ	0.72
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.71
34A	3,4-DIMETHYLANILINE	A	1L4K	0.72
NYL	N-ALLYL-ANILINE	A	1OVK	0.71
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.71
4PG	1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine	U	2R2W	0.7
PTU	2-ETHYL-1-PHENYL-ISOTHIOUREA	A,B	1K2T	0.76
PTU	2-ETHYL-1-PHENYL-ISOTHIOUREA	A,B	1D1V	0.76
PRY	2-PROPYL-ANILINE	A	1OWY	0.74
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.7
MGR	MALACHITE GREEN	A,B	3BQZ	0.74
MGR	MALACHITE GREEN	A	1Q8N	0.74
MGR	MALACHITE GREEN	A,B	3BR0	0.74
MGR	MALACHITE GREEN	A,D,E	3BTL	0.74
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.74
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.74
TFM	S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA	A,B	1K2U	0.81
IDM	INDOLINE	A,B	3CEP	0.73
IDM	INDOLINE	A	1AEK	0.73
PL0	1-phenylguanidine	A	2O8W	0.75
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.71
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.74
264	(phenylamino)acetonitrile	A	2RBN	0.7
ZMG	(5R)-2-[(2-fluorophenyl)amino]- 5-(1-methylethyl)-1,3-thiazol-4(5H)- one	A,B,C,D	2RBE	0.75
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.72
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.76