Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02252530
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 |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.72 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.7 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.72 | |
U13 | 4-(4-FLUORO-PHENYLAZO)-5-IMINO- 5H-PYRAZOL-3-YLAMINE | A | 2GG3 | 0.72 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.72 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.72 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.74 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.71 | |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.72 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.75 | |
PHZ | 1-PHENYLHYDRAZINE | A | 2E2T | 0.73 | |
PHZ | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.73 | |
NBE | NITROSOBENZENE | A | 1LH7 | 0.7 | |
NBE | NITROSOBENZENE | A | 2LH7 | 0.7 | |
NBE | NITROSOBENZENE | A | 2NSS | 0.7 | |
TFM | S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA | A,B | 1K2U | 0.87 | |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.71 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.75 | |
ANL | ANILINE | A | 2OV4 | 0.76 | |
ANL | ANILINE | A | 1AEE | 0.76 | |
ANL | ANILINE | A | 1PPA | 0.76 | |
ANL | ANILINE | A | 1HJ9 | 0.76 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.73 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.7 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 1 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 1 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.71 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.71 | |
ZMG | (5R)-2-[(2-fluorophenyl)amino]- 5-(1-methylethyl)-1,3-thiazol-4(5H)- one | A,B,C,D | 2RBE | 0.75 | |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.71 |