Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00290959
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 |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.74 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.74 | |
N2M | 5-AMINO-NAPHTALENE-2-MONOSULFONATE | C,D | 1HKN | 0.74 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.78 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.78 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.73 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.71 | |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.7 | |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.7 | |
I7C | 4-AMINO-6-(TRIFLUOROMETHYL)BENZENE- 1,3-DISULFONAMIDE | A | 2POW | 0.71 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.71 | |
PND | P-NITROPHENYLHYDRAZINE | A,G | 1JMZ | 0.7 | |
MNS | 5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDE | A | 1OKL | 0.71 | |
3CZ | (2R)-1-[(4-tert-butylphenyl)sulfonyl]- 2-methyl-4-(4-nitrophenyl)piperazine | A,B | 3CZR | 0.73 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.77 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
NR2 | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.73 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.79 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.79 | |
NP1 | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.71 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.75 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.75 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.75 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.75 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.75 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.75 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.75 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.75 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.71 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.8 | |
5NS | 5-aminonaphthalene-1-sulfonic acid | A,B | 3CFT | 0.74 | |
SBN | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE | A | 1JLQ | 0.73 | |
UA5 | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.74 |