MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02339207

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
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.77
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.77
264	(phenylamino)acetonitrile	A	2RBN	0.9
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
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.8
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine	A,B,D	3GQT	0.71
BSU	1,3-DIPHENYLUREA	A	3E85	0.76
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.76
1AN	2-FLUOROANILINE	A	1LGW	0.74
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE	A	2BGE	0.75
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.74
IDM	INDOLINE	A,B	3CEP	0.79
IDM	INDOLINE	A	1AEK	0.79
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.73
5AN	3,5-DIFLUOROANILINE	A	1LGX	0.72
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.75
PH3	N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE	A,B	1DM6	0.72
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.77
CF3	9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE	A,B,C,D	2GH6	0.7
PRY	2-PROPYL-ANILINE	A	1OWY	0.71
PHZ	1-PHENYLHYDRAZINE	A	2E2T	0.71
PHZ	1-PHENYLHYDRAZINE	D,H	2AGL	0.71
NYL	N-ALLYL-ANILINE	A	1OVK	0.93
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.75
ANL	ANILINE	A	2OV4	0.76
ANL	ANILINE	A	1AEE	0.76
ANL	ANILINE	A	1PPA	0.76
ANL	ANILINE	A	1HJ9	0.76
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.76
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.76
PL0	1-phenylguanidine	A	2O8W	0.77
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
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.71
1MR	N-METHYLANILINE	X	2OTZ	0.88