Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00490418
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 |
AMS![]() | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.74 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.72 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.72 | ![]() |
URS![]() | N-PHENYLTHIOUREA | A,B | 1BUG | 0.77 | ![]() |
APB![]() | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.7 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.85 | ![]() |
NHP![]() | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.72 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.83 | ![]() |
IDM![]() | INDOLINE | A,B | 3CEP | 0.71 | ![]() |
IDM![]() | INDOLINE | A | 1AEK | 0.71 | ![]() |
OSP![]() | SULTHIAME | A | 2Q1Q | 0.75 | ![]() |
SAN![]() | SULFANILAMIDE | A | 1AJ0 | 0.75 | ![]() |
AAS![]() | 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE | A | 1CZM | 0.71 | ![]() |
NP2![]() | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.72 | ![]() |
259![]() | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.73 | ![]() |
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 | ![]() |
PL0![]() | 1-phenylguanidine | A | 2O8W | 0.74 | ![]() |
T2D![]() | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.71 | ![]() |
LJG![]() | N,N'-(iminodiethane-2,1-diyl)bis[4- amino-N-(2-methylpropyl)benzenesulfonamide] | B | 3BGB | 0.72 | ![]() |
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 | 0.71 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.71 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.84 | ![]() |
GNR![]() | 2-(3,4-DIHYDRO-3-OXO-2H-BENZO[B][1,4]THIAZIN- 2-YL)-N-HYDROXYACETAMIDE | A,B | 1S17 | 0.71 | ![]() |
5BM![]() | (2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrile | A | 3EQH | 0.74 | ![]() |
171![]() | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.77 | ![]() |
ASR![]() | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.7 | ![]() |
TYX![]() | S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE | A | 2PQT | 0.72 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.71 | ![]() |
PHJ![]() | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.73 | ![]() |