MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00787080

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
BMS		A,B	1DKF	0.73
8CA	9-benzyl-2,3,4,9-tetrahydro-1H- carbazole-8-carboxylic acid	A	3FR2	0.71
POO	3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN- 3-YL)METHYL]AMINO}-2-OXOETHYL)- 2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID	A	2BRL	0.72
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	C	2JQ7	0.7
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	B	1OLN	0.7
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	A	1E9W	0.7
LG2	6-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8- TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE- 3-CARBOXYLIC ACID	A,B,C,D	1H9U	0.72
225	FELODIPINE	A	2NNJ	0.72
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.81
9AC	9-ACRIDINECARBONYL	A,B,G,J,K,L,M	1G3X	0.71
DK1	5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID	A,B	1PBQ	0.75
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A,B	2QYN	0.81
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A,B	2QYK	0.81
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A	2QYL	0.81
IMN	INDOMETHACIN	A	2BXM	0.74
IMN	INDOMETHACIN	A	3FO7	0.74
IMN	INDOMETHACIN	A,B,C,D	1Z9H	0.74
IMN	INDOMETHACIN	A	2BXQ	0.74
IMN	INDOMETHACIN	A,B,C,D	4COX	0.74
IMN	INDOMETHACIN	A	2ALT	0.74
IMN	INDOMETHACIN	A	2OTH	0.74
IMN	INDOMETHACIN	A,B	2DM6	0.74
IMN	INDOMETHACIN	A	1S2A	0.74
IMN	INDOMETHACIN	A	2ZB8	0.74
IMN	INDOMETHACIN	A	3HWZ	0.74
IMN	INDOMETHACIN	A	2BXK	0.74
CMF	3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL- 2-OXOETHYL)-2-PHENYL-1H-INDOLE- 6-CARBOXYLIC ACID	A	2BRK	0.71
MTK	MONTELUKAST	A	2NNI	0.74
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.7
NZA	5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q5S	0.71
A46	5-chloro-N-{4-[(1R)-1,2-dihydroxyethyl]phenyl}- 1H-indole-2-carboxamide	A,B	2ZB2	0.71
SF1	1-BENZYL-5-CHLORO-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q61	0.7
1IQ	2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID	A	1Z8N	0.74
I4A	5-(3-carbamoylbenzyl)-5,6,7,8,9,10- hexahydrocyclohepta[b]indole-4- carboxylic acid	A	3FR5	0.71
HQU	3-HYDROXYQUINALDIC ACID	C,D	193D	0.71
QND	QUINALDIC ACID	A,B	1IDA	0.77
238		A	2PRH	0.85
BRF		A	1UUO	0.81
VX3	2,3-diphenyl-1H-indole-7-carboxylic acid	A	3BGZ	0.71