Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02273827
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 |
DZF | 5-DEAZAFOLIC ACID | A,B | 2DHF | 0.76 | |
DZF | 5-DEAZAFOLIC ACID | A,B | 1DYH | 0.76 | |
DZF | 5-DEAZAFOLIC ACID | A,B,C,D | 1CDE | 0.76 | |
DVP | METHYL 1-(4-{[(2,4-DIAMINOPTERIDIN- 6-YL)METHYL]AMINO}BENZOYL)PIPERIDINE- 4-CARBOXYLATE | A,B,C,D,E,F, G,H | 3H4V | 0.74 | |
D16 | TOMUDEX | A,B | 1I00 | 0.74 | |
D16 | TOMUDEX | A,B | 2KCE | 0.74 | |
D16 | TOMUDEX | A,B,C,D | 2TSR | 0.74 | |
D16 | TOMUDEX | A,B,C,D | 1HVY | 0.74 | |
D16 | TOMUDEX | A,B | 1RTS | 0.74 | |
796 | N-[(1S)-2-AMINO-1-(2,4-DICHLOROBENZYL)ETHYL]- 5-[2-(METHYLAMINO)PYRIMIDIN-4-YL]THIOPHENE- 2-CARBOXAMIDE | A | 2GU8 | 0.71 | |
C24 | 3-({2-[(4-CARBAMIMIDOYL-PHENYLAMINO)- METHYL]-3-METHYL-3H-BENZOIMIDAZOLE- 5-CARBONYL}-PYRIDIN-2-YL-AMINO)- PROPIONIC ACID ETHYL ESTER | B,C | 1KTS | 0.73 | |
FE1 | METHYL 1-(4-{[(2,4-DIAMINOPTERIDIN- 6-YL)METHYL](METHYL)AMINO}BENZOYL)PIPERIDINE- 4-CARBOXYLATE | A,B,C,D | 2QHX | 0.72 | |
3BI | (2S)-2-{[(R)-[(3R)-3-carboxy-3- {[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}phenyl)carbonyl]amino}propyl](hydroxy)phosphoryl]methyl}pentanedioic acid | A | 3BI1 | 0.75 | |
626 | 4-(4-METHYLPIPERAZIN-1-YL)-N-[5- (2-THIENYLACETYL)-1,5-DIHYDROPYRROLO[3,4- C]PYRAZOL-3-YL]BENZAMIDE | A | 2OWB | 0.72 | |
626 | 4-(4-METHYLPIPERAZIN-1-YL)-N-[5- (2-THIENYLACETYL)-1,5-DIHYDROPYRROLO[3,4- C]PYRAZOL-3-YL]BENZAMIDE | A,B | 2J4Z | 0.72 | |
B18 | (4R)-N-[4-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)- 1,3-THIAZOL-2-YL]-4-METHYL-1-OXO- 2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE- 6-CARBOXAMIDE | A,B,C | 2PZY | 0.74 | |
G95 | N-[(1S)-2-amino-1-phenylethyl]- 5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene- 2-carboxamide | A,B | 3E87 | 0.72 | |
FOL | FOLIC ACID | A | 1PJ6 | 0.78 | |
FOL | FOLIC ACID | A,B | 1RD7 | 0.78 | |
FOL | FOLIC ACID | A,B | 1DHF | 0.78 | |
FOL | FOLIC ACID | A,B,C,D,E | 1QZF | 0.78 | |
FOL | FOLIC ACID | A | 4CD2 | 0.78 | |
FOL | FOLIC ACID | A | 1RX7 | 0.78 | |
FOL | FOLIC ACID | A | 1RX2 | 0.78 | |
FOL | FOLIC ACID | A | 1RX8 | 0.78 | |
FOL | FOLIC ACID | A | 1RA2 | 0.78 | |
FOL | FOLIC ACID | A,B | 1RE7 | 0.78 | |
FOL | FOLIC ACID | A | 7DFR | 0.78 | |
FOL | FOLIC ACID | A | 1VIF | 0.78 | |
FOL | FOLIC ACID | A,B | 1RB2 | 0.78 | |
FOL | FOLIC ACID | A | 1CD2 | 0.78 | |
FOL | FOLIC ACID | A | 2CD2 | 0.78 | |
FOL | FOLIC ACID | A,B | 1DYI | 0.78 | |
FOL | FOLIC ACID | A | 1DRF | 0.78 | |
FOL | FOLIC ACID | A,B,C,D | 3BMC | 0.78 | |
FOL | FOLIC ACID | A,B | 2D0K | 0.78 | |
FOL | FOLIC ACID | A | 1RA8 | 0.78 | |
FRX | (S)-2-CHLORO-N-(1-(2-(2-HYDROXYETHYLAMINO)- 2-OXOETHYL)-2-OXO-1,2,3,4-TETRAHYDROQUINOLIN- 3-YL)-6H-THIENO[2,3-B]PYRROLE-5- CARBOXAMIDE | A,B | 2IEI | 0.7 | |
GPB | N-[4-[2-(2-AMINO-4-METHYL-7H-PYRROLO[2,3- D]PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]GLUTAMIC ACID | A | 1E26 | 0.7 | |
G37 | 2-(BENZYLCARBAMOYL-PHENYLACETYLAMINO- METHYL)-5,5-DIMETHYL-THIAZOLIDINE- 4-CARBOXYLIC ACID 3-[(1H-BENZIMIDAZOL- 2-YLMETHYLCARBAMOYL)-1-BENZYL-2- HYDROXYPROPYL]-AMIDE | A | 1HTG | 0.7 | |
CY0 | S-{3-[(4-ANILINOQUINAZOLIN-6-YL)AMINO]- 3-OXOPROPYL}-L-CYSTEINE | A | 2J5E | 0.73 | |
165 | N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL- N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE | H,I | 1SB1 | 0.7 | |
4QB | 3-{2-ETHYL-6-[4-(QUINOXALIN-2-YLAMINO)- BENZOYLAMINO]-HEXANOYLAMINO}-4- OXO-BUTYRIC ACID | A | 1RWN | 0.78 | |
737 | N-[4-GUANIDINO-1-(THIAZOLE-2-CARBONYL)- BUTYL]-2-{6-OXO-5-[(QUINOLIN-8- YLMETHYL)-AMINO]-2-M-TOLYL-6H-PYRIMIDIN- 1-YL}-ACETAMIDE | A | 1ZTL | 0.71 | |
COP | N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID | A | 1OHJ | 0.74 | |
COP | N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID | A | 1OHK | 0.74 | |
BTH | 4-OXO-3-{6-[4-(QUINOXALIN-2-YLAMINO)- BENZOYLAMINO]-2-THIOPHEN-2-YL-HEXANOYLAMINO}- PENTANOIC ACID | A | 1RWO | 0.88 |