Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03219832
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
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 |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.73 | |
EBW | 4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}- 3-OXOPENTYL)-N,N-DIMETHYL-N-PROP- 2-ENYLBENZENAMINIUM | A | 1E3Q | 0.75 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.73 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.73 | |
TTT | 5-amino-2-methyl-N-[(1R)-1-naphthalen- 1-ylethyl]benzamide | A | 3E9S | 0.71 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.72 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.74 | |
ISN | ISATIN | A,B | 1OJA | 0.75 | |
ISN | ISATIN | A,B | 2BK5 | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.71 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.71 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.75 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.75 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.71 | |
ISO | PARA-ISOPROPYLANILINE | A | 1BMA | 0.72 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.72 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.72 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.72 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.89 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.71 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.71 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.73 | |
AQO | 2-AMINOQUINAZOLIN-4(3H)-ONE | A | 1S39 | 0.71 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.74 | |
TSN | TRICHOSTATIN A | A,B | 1T64 | 0.76 | |
TSN | TRICHOSTATIN A | A,B | 1C3R | 0.76 | |
TSN | TRICHOSTATIN A | A,B,C | 3F0R | 0.76 | |
TSN | TRICHOSTATIN A | A,B,C | 3C10 | 0.76 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.72 | |
UA5 | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.7 | |
12B | BENZO[CD]INDOL-2(1H)-ONE | A,B | 2F67 | 0.71 | |
IBR | A | 9EST | 0.72 | ||
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.77 | |
C16 | 4-(4-methyl-1,3-dioxo-1,3-dihydro- 2H-isoindol-2-yl)benzonitrile | A | 3BNZ | 0.7 | |
PHM | PHENYLALANYLMETHANE | A,I | 1PJP | 0.7 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2J9J | 0.7 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2JE4 | 0.7 | |
PMZ | 1-[10-(3-DIMETHYLAMINO-PROPYL)- 10H-PHENOTHIAZIN-2-YL]-ETHANONE | A | 1LVJ | 0.7 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.73 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.75 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.7 | |
NID | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.83 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.76 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.74 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.74 | |
KYN | KYNURENINE | A | 1XT7 | 0.74 | |
KYN | KYNURENINE | A | 1T5M | 0.74 | |
KYN | KYNURENINE | A | 1T5N | 0.74 | |
KYN | KYNURENINE | A | 2VOV | 0.74 | |
KYN | KYNURENINE | A | 2VOX | 0.74 | |
APZ | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.76 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.71 |