MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02258493

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
AGB	N-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREA	A	1EJN	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.75
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.89
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.77
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.77
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	2BDI	0.77
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.77
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.77
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.77
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.77
A8B		A	1ODC	0.73
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.77
1MR	N-METHYLANILINE	X	2OTZ	0.72
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.72
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.73
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	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
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.72
PL0	1-phenylguanidine	A	2O8W	0.71
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.75
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.75
IDM	INDOLINE	A,B	3CEP	0.75
IDM	INDOLINE	A	1AEK	0.75
264	(phenylamino)acetonitrile	A	2RBN	0.73
GP6	1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA	A	1BJU	0.71
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.7
NYL	N-ALLYL-ANILINE	A	1OVK	0.74
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.75
MGR	MALACHITE GREEN	A	1Q8N	0.75
MGR	MALACHITE GREEN	A,B	3BR0	0.75
MGR	MALACHITE GREEN	A,D,E	3BTL	0.75
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.75
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.75
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.76
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.76
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.75
BRN	BERENIL	A,B	268D	0.73
BRN	BERENIL	A,B	1D63	0.73
BRN	BERENIL	A,D,E	2GBY	0.73
BRN	BERENIL	A	2DBE	0.73
BRN	BERENIL	A	2GVR	0.73