MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03023908

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
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.7
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.7
DPK	DEPRENYL	A,B	2BYB	0.8
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1- YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.77
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.74
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.73
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.75
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE	A,B,C,D	1TP7	0.72
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.7
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.7
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.7
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.72
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.76
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.76
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.71
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.71
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.73
271	N-methyl-1-phenylmethanamine	X	2RBT	0.76
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N- DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H- PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.72
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.73
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL- 2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO- 1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.71
PZQ	PRAZIQUANTEL	A	1GTB	0.71
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.7
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.74
4PI	N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE	A,B	2NSD	0.75
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.73
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.73
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.94
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl- 4-phenylpentyl]piperidine	A	2JJG	0.86
MGR	MALACHITE GREEN	A,B	3BQZ	0.7
MGR	MALACHITE GREEN	A	1Q8N	0.7
MGR	MALACHITE GREEN	A,B	3BR0	0.7
MGR	MALACHITE GREEN	A,D,E	3BTL	0.7
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.7
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.7
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.83
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.71