Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03883881
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 |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.7 | ![]() |
AMS![]() | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.74 | ![]() |
171![]() | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.83 | ![]() |
NP2![]() | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.75 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.9 | ![]() |
URS![]() | N-PHENYLTHIOUREA | A,B | 1BUG | 0.77 | ![]() |
ROK![]() | 4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDE | A,B,C,D,E,F, G,H | 2VT5 | 0.76 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.73 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.73 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.73 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.74 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.74 | ![]() |
TYX![]() | S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE | A | 2PQT | 0.71 | ![]() |
UFO![]() | 1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine | A,B,D | 3GQT | 0.71 | ![]() |
ANL![]() | ANILINE | A | 2OV4 | 0.74 | ![]() |
ANL![]() | ANILINE | A | 1AEE | 0.74 | ![]() |
ANL![]() | ANILINE | A | 1PPA | 0.74 | ![]() |
ANL![]() | ANILINE | A | 1HJ9 | 0.74 | ![]() |
SAN![]() | SULFANILAMIDE | A | 1AJ0 | 0.75 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.87 | ![]() |
AAS![]() | 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE | A | 1CZM | 0.71 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.75 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.75 | ![]() |
NP1![]() | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.7 | ![]() |
T2D![]() | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.74 | ![]() |
APB![]() | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.73 | ![]() |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.71 | ![]() |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.71 | ![]() |
MPX![]() | 4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE | A | 1ZH9 | 0.72 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 3E85 | 0.73 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 2ZJF | 0.73 | ![]() |
34T![]() | (3R)-8-(dioxidosulfanyl)-3-methyl- 1,2,3,4-tetrahydroquinoline | H | 1ETR | 0.74 | ![]() |
NR2![]() | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.7 | ![]() |
PL0![]() | 1-phenylguanidine | A | 2O8W | 0.74 | ![]() |
OSP![]() | SULTHIAME | A | 2Q1Q | 0.79 | ![]() |
1AN![]() | 2-FLUOROANILINE | A | 1LGW | 0.71 | ![]() |
ASR![]() | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.73 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | ![]() |
PHJ![]() | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.74 | ![]() |
LJG![]() | N,N'-(iminodiethane-2,1-diyl)bis[4- amino-N-(2-methylpropyl)benzenesulfonamide] | B | 3BGB | 0.75 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.88 | ![]() |
IDM![]() | INDOLINE | A,B | 3CEP | 0.77 | ![]() |
IDM![]() | INDOLINE | A | 1AEK | 0.77 | ![]() |