Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01762750
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 |
OSP | SULTHIAME | A | 2Q1Q | 0.78 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.77 | |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.72 | |
CBE | 2-METHYL-N-PHENYL-5,6-DIHYDRO-1,4- OXATHIINE-3-CARBOXAMIDE | A,B,C,D,N,O, P,Q | 2FBW | 0.76 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.7 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.77 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.74 | |
AAS | 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE | A | 1CZM | 0.71 | |
SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1C3S | 0.7 | |
SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C | 3C0Z | 0.7 | |
SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1T69 | 0.7 | |
SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C,D | 1ZZ1 | 0.7 | |
T2D | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.74 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.75 | |
171 | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.88 | |
SUA | (4-SULFAMOYL-PHENYL)-THIOCARBAMIC ACID O- (2-THIOPHEN-3-YL-ETHYL) ESTER | A | 1LUG | 0.71 | |
ETP | 3-(4-BENZENESULFONYL-THIOPHENE- 2-SULFONYLAMINO)-PHENYLBORONIC ACID | A,B | 1GA9 | 0.73 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.79 | |
TYX | S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE | A | 2PQT | 0.75 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.73 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.73 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.74 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.74 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.74 | |
ROK | 4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDE | A,B,C,D,E,F, G,H | 2VT5 | 0.72 | |
ANL | ANILINE | A | 2OV4 | 0.71 | |
ANL | ANILINE | A | 1AEE | 0.71 | |
ANL | ANILINE | A | 1PPA | 0.71 | |
ANL | ANILINE | A | 1HJ9 | 0.71 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.76 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.76 | |
ZMG | (5R)-2-[(2-fluorophenyl)amino]- 5-(1-methylethyl)-1,3-thiazol-4(5H)- one | A,B,C,D | 2RBE | 0.73 | |
GNR | 2-(3,4-DIHYDRO-3-OXO-2H-BENZO[B][1,4]THIAZIN- 2-YL)-N-HYDROXYACETAMIDE | A,B | 1S17 | 0.71 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.72 | |
PHJ | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.75 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.77 | |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.76 |