MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02410357

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
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.85
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.74
GP6	1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA	A	1BJU	0.72
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.72
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.76
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.75
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.75
264	(phenylamino)acetonitrile	A	2RBN	0.71
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.71
SC5	2-[((R)-{[4-(AMINOMETHYL)PHENYL]AMINO}{[(1R)- 1-PHENYLETHYL]AMINO}METHYL)AMINO]ETHANE- 1,1-DIOL	H	1YNK	0.7
MGR	MALACHITE GREEN	A,B	3BQZ	0.76
MGR	MALACHITE GREEN	A	1Q8N	0.76
MGR	MALACHITE GREEN	A,B	3BR0	0.76
MGR	MALACHITE GREEN	A,D,E	3BTL	0.76
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.76
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.76
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.78
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.72
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.75
IDM	INDOLINE	A,B	3CEP	0.73
IDM	INDOLINE	A	1AEK	0.73
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.76
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.76
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.76
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.76
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.76
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.76
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.76
FTA	3-(4-PHENYLAMINO-PHENYLAMINO)-2- (1H-TETRAZOL-5-YL)-ACRYLONITRILE	A	1PZP	0.7
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.71
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.74
NYL	N-ALLYL-ANILINE	A	1OVK	0.72
BRN	BERENIL	A,B	268D	0.75
BRN	BERENIL	A,B	1D63	0.75
BRN	BERENIL	A,D,E	2GBY	0.75
BRN	BERENIL	A	2DBE	0.75
BRN	BERENIL	A	2GVR	0.75
A8B		A	1ODC	0.71
1MR	N-METHYLANILINE	X	2OTZ	0.71