MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03315647

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
1AN	2-FLUOROANILINE	A	1LGW	0.72
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.78
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.73
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.73
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.73
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.76
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.74
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.71
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.78
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.74
PL0	1-phenylguanidine	A	2O8W	0.79
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.71
BSU	1,3-DIPHENYLUREA	A	3E85	0.76
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.76
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE	A	2BGE	0.75
5AN	3,5-DIFLUOROANILINE	A	1LGX	0.7
ANL	ANILINE	A	2OV4	0.75
ANL	ANILINE	A	1AEE	0.75
ANL	ANILINE	A	1PPA	0.75
ANL	ANILINE	A	1HJ9	0.75
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
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.73
1MR	N-METHYLANILINE	X	2OTZ	0.86
264	(phenylamino)acetonitrile	A	2RBN	0.94
PHZ	1-PHENYLHYDRAZINE	A	2E2T	0.71
PHZ	1-PHENYLHYDRAZINE	D,H	2AGL	0.71
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.76
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.76
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.73
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.76
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.76
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.78
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.71
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.71
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.71
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.71
FTA	3-(4-PHENYLAMINO-PHENYLAMINO)-2- (1H-TETRAZOL-5-YL)-ACRYLONITRILE	A	1PZP	0.73
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.71
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.72
NYL	N-ALLYL-ANILINE	A	1OVK	0.91
IDM	INDOLINE	A,B	3CEP	0.77
IDM	INDOLINE	A	1AEK	0.77