Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02396166
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 |
MIY | (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)- 3,10,12,12A-TETRAHYDROXY-1,11-DIOXO- 1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE- 2-CARBOXAMIDE | A | 2DRD | 0.7 |  |
TDC | 5A,6-ANHYDROTETRACYCLINE | A | 2VKV | 0.77 | |
| TDC | 5A,6-ANHYDROTETRACYCLINE | A | 2VPR | 0.77 | |
ATC | 9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY- 6-DEMETHYL-TETRACYCLINE | A | 1ORK | 0.7 | |
GBX | 2-AMINO-4-[1-(CARBOXYMETHYL-CARBAMOYL)- 2-(9-HYDROXY-7,8-DIOXO-7,8,9,10- TETRAHYDRO-BENZO[DEF]CHRYSEN-10- YLSULFANYL)-ETHYLCARBAMOYL]-BUTYRIC ACID | A,B | 4PGT | 0.72 | |
| GBX | 2-AMINO-4-[1-(CARBOXYMETHYL-CARBAMOYL)- 2-(9-HYDROXY-7,8-DIOXO-7,8,9,10- TETRAHYDRO-BENZO[DEF]CHRYSEN-10- YLSULFANYL)-ETHYLCARBAMOYL]-BUTYRIC ACID | A,B | 3PGT | 0.72 | |
| GBX | 2-AMINO-4-[1-(CARBOXYMETHYL-CARBAMOYL)- 2-(9-HYDROXY-7,8-DIOXO-7,8,9,10- TETRAHYDRO-BENZO[DEF]CHRYSEN-10- YLSULFANYL)-ETHYLCARBAMOYL]-BUTYRIC ACID | A,B | 1F3B | 0.72 | |
| GBX | 2-AMINO-4-[1-(CARBOXYMETHYL-CARBAMOYL)- 2-(9-HYDROXY-7,8-DIOXO-7,8,9,10- TETRAHYDRO-BENZO[DEF]CHRYSEN-10- YLSULFANYL)-ETHYLCARBAMOYL]-BUTYRIC ACID | A,B | 1ML6 | 0.72 | |
5PH | 5-[5-(1-CARBOXYMETHYL-2-OXO-PROPYLCARBAMOYL)- 5-PHENYL-PENTYLSULFAMOYL]-2-HYDROXY- BENZOIC ACID | A | 1RWV | 0.72 | |
D2C | (2S,4S,4AR,5AS,6S,11R,11AS,12R,12AR)- 7-CHLORO-4-(DIMETHYLAMINO)-6,10,11,12- TETRAHYDROXY-1,3-DIOXO-1,2,3,4,4A,5,5A,6,11,11A,12,12A- DODECAHYDROTETRACENE-2-CARBOXAMIDE | A,D,M,N,Z | 2F4V | 0.72 | |
JE2 | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | A,B | 1KZK | 0.71 | |
| JE2 | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | B | 1MSM | 0.71 | |
| JE2 | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | A,B | 2ANL | 0.71 | |
| JE2 | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | B | 1MSN | 0.71 | |
CTC | 7-CHLOROTETRACYCLINE | A | 1BJ0 | 0.75 | |
| CTC | 7-CHLOROTETRACYCLINE | A,B | 1BJY | 0.75 | |
| CTC | 7-CHLOROTETRACYCLINE | A | 2FJ1 | 0.75 | |
| CTC | 7-CHLOROTETRACYCLINE | A | 1DU7 | 0.75 | |
| CTC | 7-CHLOROTETRACYCLINE | A,B | 3EGZ | 0.75 | |
| CTC | 7-CHLOROTETRACYCLINE | A | 2TCT | 0.75 | |
TAC | TETRACYCLINE | A,B,C,D,E,F, G,H,I,J,K,L | 2HDN | 0.8 | |
| TAC | TETRACYCLINE | A | 2VKE | 0.8 | |
| TAC | TETRACYCLINE | A | 2TRT | 0.8 | |
| TAC | TETRACYCLINE | B | 2UXO | 0.8 | |
| TAC | TETRACYCLINE | A,B,D,E,G,H, J,K,L,N,P,Q, R,T | 1I97 | 0.8 | |
| TAC | TETRACYCLINE | A,D,H,N | 1HNW | 0.8 | |
| TAC | TETRACYCLINE | A,B | 2HCJ | 0.8 | |
NCG | A | 1MP7 | 0.7 | | |
DXT | (4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)- 3,5,10,12,12A-PENTAHYDROXY-6-METHYL- 1,11-DIOXO-1,4,4A,5,5A,6,11,12A- OCTAHYDROTETRACENE-2-CARBOXAMIDE | A | 2O7O | 0.76 | |