Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00341618
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 |
NCK | 3,6-Bis[3-(4-methylpiperidino)propionamido]acridine | A,B | 3ES0 | 0.71 | |
FQX | [1,2,5]oxadiazolo[3,4-g]quinoxaline- 6,7(5H,8H)-dione 1-oxide | B,C,D,P | 3BKI | 0.77 | |
BBZ | 2'-(4-DIMETHYLAMINOPHENYL)-5-(4- METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE | B | 447D | 0.7 | |
BBZ | 2'-(4-DIMETHYLAMINOPHENYL)-5-(4- METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE | B | 1QV8 | 0.7 | |
CM6 | (2S)-2-[(2,1,3-BENZOTHIADIAZOL- 4-YLSULFONYL)AMINO]-2-PHENYL-N- PYRIDIN-4-YLACETAMIDE | A | 2CIB | 0.71 | |
MHC | 3-MERCAPTO-1-(1,3,4,9-TETRAHYDRO- B-CARBOLIN-2-YL)-PROPAN-1-ONE | A | 1NBP | 0.74 | |
BRA | 9-[4-(n,n-dimethylamino)phenylamino]- 3,6-bis(3-pyrrolidinopropionamido) acridine | A | 3CE5 | 0.72 | |
NCJ | 3,6-Bis{3-[(2R)-2-methylpiperidino)]propionamido}acridine | A,B | 3ERU | 0.7 | |
QYT | (5E)-5-(QUINOXALIN-6-YLMETHYLENE)- 1,3-THIAZOLIDINE-2,4-DIONE | A | 2A5U | 0.7 | |
PPX | [PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN- 4-YLAMINO)-ETHYL]-AMINE | E,H | 1QBV | 0.72 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL7 | 0.76 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL6 | 0.76 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CE2 | 0.76 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2EVW | 0.76 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL0 | 0.76 | |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CLC | 0.76 | |
GIQ | 3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN- 2-AMINE | A | 2Z2G | 0.7 | |
GIQ | 3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN- 2-AMINE | A | 2Z2H | 0.7 | |
GIQ | 3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN- 2-AMINE | A | 2HKC | 0.7 | |
PYN | 3-PYRROLIDIN-1-YL-N-[6-(3-PYRROLIDIN- 1-YL-PROPIONYLAMINO)-ACRIDIN-3- YL]-PROPIONAMIDE | A,B | 1L1H | 0.73 | |
NCL | 3,6-Bis{3-(3-[(3R)-methylpiperidino)]propionamido}acridine | A,B | 3ET8 | 0.71 | |
BMI | 3-[5-(1H-IMIDAZOL-1-YL)-7-METHYL- 1H-BENZIMIDAZOL-2-YL]-4-[(PYRIDIN- 2-YLMETHYL)AMINO]PYRIDIN-2(1H)- ONE | A | 2OJ9 | 0.7 | |
AAI | trans-4-(7-carbamoyl-1H-benzimidazol- 2-yl)-1-propylpiperidinium | A | 2RCW | 0.71 | |
2PT | 1-[2-(ACRIDIN-9-YLAMINO)ETHYL]- 1,3-DIMETHYLTHIOUREA-PLATINUM(II)- ETHANE-1,2-DIAMINE | B | 1XRW | 0.71 |