Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02901672
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 |
I06 | 2-PHENETHYL-2,3-DIHYDRO-PHTHALAZINE- 1,4-DIONE | D,E,F,G,H,L, M,N,O,P | 1EEF | 0.77 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.71 | |
4PI | N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE | A,B | 2NSD | 0.71 | |
KR2 | (2R)-4-(2-BENZOYL-1,2-DIAZEPAN- 1-YL)-4-OXO-1-(2,4,5-TRIFLUOROPHENYL)BUTAN- 2-AMINE | A,B | 2OLE | 0.72 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.84 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.84 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.78 | |
BZZ | BENZYLHYDRAZINE | A,B | 2E2V | 0.74 | |
605 | 4'-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]biphenyl- 3-carboxamide | A,B | 3D4L | 0.73 | |
SP9 | N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNT | 0.76 | |
U1N | 4-[(3R)-3-{[2-(4-FLUOROPHENYL)- 2-OXOETHYL]AMINO}BUTYL]BENZAMIDE | A,B | 2OGZ | 0.72 | |
SAB | 4-SULFONAMIDE-[1-(4-AMINOBUTANE)]BENZAMIDE | A | 1OKM | 0.71 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.71 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.71 | |
KHA | 1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)- 1-METHYLPIPERIDINIUM | H,L,X,Y | 1UWG | 0.71 | |
DPZ | 3,5-DIAMINOPHTHALHYDRAZIDE | A | 1F3E | 0.71 | |
SP8 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNS | 0.76 | |
RXA | isoquinoline-1,3,4(2H)-trione | A,B,C,D | 3DEH | 0.7 | |
LSA | 1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1- DIOXIDE | A | 2Q1B | 0.72 | |
LSA | 1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1- DIOXIDE | A | 2Q38 | 0.72 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SN9 | 0.7 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1SNE | 0.7 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SNA | 0.7 | |
DBZ | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1XOF | 0.7 | |
BVA | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.82 | |
BSA | 2-(BENZOYLAMINO)ETHANESULFONIC ACID | A | 1YQS | 0.7 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2BTJ | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D,E,F | 2EFX | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2VVJ | 0.73 | |
NFA | PHENYLALANINE AMIDE | A | 2A4O | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B | 1XAE | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2OGR | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 1QA7 | 0.73 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2GW4 | 0.73 | |
APZ | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.76 | |
BSB | N-BENZYL-4-SULFAMOYL-BENZAMIDE | A | 1G4O | 0.7 |