MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02138100

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
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.72
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.7
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.75
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.71
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.78
ZMG	(5R)-2-[(2-fluorophenyl)amino]- 5-(1-methylethyl)-1,3-thiazol-4(5H)- one	A,B,C,D	2RBE	0.8
264	(phenylamino)acetonitrile	A	2RBN	0.71
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.71
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.72
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.7
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.7
NYL	N-ALLYL-ANILINE	A	1OVK	0.71
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.7
34A	3,4-DIMETHYLANILINE	A	1L4K	0.7
MGR	MALACHITE GREEN	A,B	3BQZ	0.71
MGR	MALACHITE GREEN	A	1Q8N	0.71
MGR	MALACHITE GREEN	A,B	3BR0	0.71
MGR	MALACHITE GREEN	A,D,E	3BTL	0.71
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.71
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.71
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	0.71
TFM	S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA	A,B	1K2U	0.81
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.71
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.71
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.71
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.71
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.71
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.71
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.71
PL0	1-phenylguanidine	A	2O8W	0.73
IDM	INDOLINE	A,B	3CEP	0.74
IDM	INDOLINE	A	1AEK	0.74
A21	(5S)-2-{[(1S)-1-(2-fluorophenyl)ethyl]amino}- 5-methyl-5-(trifluoromethyl)-1,3- thiazol-4(5H)-one	A,B,C,D	3BZU	0.74
1MR	N-METHYLANILINE	X	2OTZ	0.71