Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02383417
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 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.72 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.72 | |
ANL | ANILINE | A | 2OV4 | 0.77 | |
ANL | ANILINE | A | 1AEE | 0.77 | |
ANL | ANILINE | A | 1PPA | 0.77 | |
ANL | ANILINE | A | 1HJ9 | 0.77 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.77 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.78 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.73 | |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.73 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.82 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.72 | |
NIN | DINITROPHENYLENE | A | 1GVY | 0.72 | |
NIN | DINITROPHENYLENE | A | 1GW1 | 0.72 | |
NBE | NITROSOBENZENE | A | 1LH7 | 0.79 | |
NBE | NITROSOBENZENE | A | 2LH7 | 0.79 | |
NBE | NITROSOBENZENE | A | 2NSS | 0.79 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.74 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.71 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.83 | |
T2D | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.73 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.76 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.76 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.74 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.74 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.74 | |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.72 | |
C1M | 1-(4-CHLOROPHENYL)-2,3-DIHYDRO- 1H-TETRAZOLE | B,I | 2C90 | 0.73 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.71 | |
MGR | MALACHITE GREEN | A | 1Q8N | 0.71 | |
MGR | MALACHITE GREEN | A,B | 3BR0 | 0.71 | |
MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.71 | |
MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.71 | |
MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.71 | |
PHZ | 1-PHENYLHYDRAZINE | A | 2E2T | 0.79 | |
PHZ | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.79 | |
OSP | SULTHIAME | A | 2Q1Q | 0.71 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.74 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.74 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.72 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.72 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.72 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.72 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.72 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.72 | |
PND | P-NITROPHENYLHYDRAZINE | A,G | 1JMZ | 0.72 | |
PHJ | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.78 | |
171 | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.73 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
IDM | INDOLINE | A,B | 3CEP | 0.7 | |
IDM | INDOLINE | A | 1AEK | 0.7 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.77 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.77 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.87 | |
IXX | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.72 | |
P1Z | 4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE- 3,5-DIONE | A,B | 2W98 | 0.7 | |
P1Z | 4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE- 3,5-DIONE | A,B | 2BXC | 0.7 | |
P1Z | 4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE- 3,5-DIONE | A | 2BXP | 0.7 | |
P1Z | 4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE- 3,5-DIONE | A | 2BXQ | 0.7 |