MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02006059

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
U12	5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE	A	2GG2	0.72
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.75
1MR	N-METHYLANILINE	X	2OTZ	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.77
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.77
PRY	2-PROPYL-ANILINE	A	1OWY	0.73
RKA	N,N'-(1H-PYRROLE-2,5-DIYLDI-4,1- PHENYLENE)DIBENZENECARBOXIMIDAMIDE	A	2GYX	0.7
IDM	INDOLINE	A,B	3CEP	0.79
IDM	INDOLINE	A	1AEK	0.79
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.73
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.75
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.75
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.75
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.75
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.75
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.75
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.75
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.7
A8B		A	1ODC	0.7
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.77
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.77
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.77
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.73
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
PL0	1-phenylguanidine	A	2O8W	0.74
AS3	4-METHYL-6-PROPYLPYRIDIN-2-AMINE	A,B	3E6N	0.7
264	(phenylamino)acetonitrile	A	2RBN	0.73
NYL	N-ALLYL-ANILINE	A	1OVK	0.74
529	(2S)-N-[(3Z)-5-CYCLOPROPYL-3H-PYRAZOL- 3-YLIDENE]-2-[4-(2-OXOIMIDAZOLIDIN- 1-YL)PHENYL]PROPANAMIDE	A,C,D	2BPM	0.71
SII	N-(4-{[4-(cyclohexylamino)-1-(3- fluorophenyl)-2-oxo-1,3,8-triazaspiro[4.5]dec- 3-en-8-yl]methyl}phenyl)acetamide	A	3FKT	0.73
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.74
U19	5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE	A	2GG5	0.73
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.71
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.71
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.87
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.71
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.72