Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01086469
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 |
U12 | 5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG2 | 0.7 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.73 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.71 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.71 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.71 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.71 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.71 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.71 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.71 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.77 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.77 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.74 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A | 1QWC | 0.72 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1FOI | 0.72 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1QW5 | 0.72 | |
U19 | 5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG5 | 0.7 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
NP1 | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.8 | |
PNC | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.71 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.75 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.83 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.83 | |
BRN | BERENIL | A,B | 268D | 0.74 | |
BRN | BERENIL | A,B | 1D63 | 0.74 | |
BRN | BERENIL | A,D,E | 2GBY | 0.74 | |
BRN | BERENIL | A | 2DBE | 0.74 | |
BRN | BERENIL | A | 2GVR | 0.74 | |
TPM | 2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM | J,K,L | 1F3D | 0.79 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.8 | |
PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.8 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.71 |