Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004695
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 |
IPO![]() | PARA-IODO-D-PHENYLALANINE HYDROXAMIC ACID | A | 1IGB | 0.7 | ![]() |
LSA![]() | 1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1- DIOXIDE | A | 2Q1B | 0.8 | ![]() |
LSA![]() | 1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1- DIOXIDE | A | 2Q38 | 0.8 | ![]() |
HBC![]() | (2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE | H | 1JGU | 0.72 | ![]() |
IPP![]() | (P-IODOPHENYLACETYLAMINO)METHYLPHOSPHINIC ACID | A,B | 1BLS | 0.7 | ![]() |
DHQ![]() | 3,4-DIHYDRO-5-METHYL-ISOQUINOLINONE | A | 1PAX | 0.74 | ![]() |
SP9![]() | N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNT | 0.8 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK1 | 0.77 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK4 | 0.77 | ![]() |
FBA![]() | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.72 | ![]() |
FBA![]() | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.72 | ![]() |
VK3![]() | MENADIONE | A | 1TUV | 0.71 | ![]() |
VK3![]() | MENADIONE | A,B | 2QR2 | 0.71 | ![]() |
BVA![]() | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.89 | ![]() |
605![]() | 4'-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]biphenyl- 3-carboxamide | A,B | 3D4L | 0.75 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.84 | ![]() |
HBX![]() | benzaldehyde | A,B | 3GDN | 0.79 | ![]() |
LAZ![]() | N-(2-AMINOETHYL)-P-CHLOROBENZAMIDE | A,B | 1OJC | 0.7 | ![]() |
HPQ![]() | HOMOPHENYLALANINYLMETHANE | B | 1EWP | 0.72 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.7 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.7 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.7 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.7 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.7 | ![]() |
STB![]() | 4-SULFONAMIDE-[4-(THIOMETHYLAMINOBUTANE)]BENZAMIDE | A | 1OKN | 0.7 | ![]() |
U1N![]() | 4-[(3R)-3-{[2-(4-FLUOROPHENYL)- 2-OXOETHYL]AMINO}BUTYL]BENZAMIDE | A,B | 2OGZ | 0.72 | ![]() |
HPK![]() | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.71 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.71 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1OB2 | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDG | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDK | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | 1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z | 1M90 | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | P | 3SGA | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | A,B,C,D,E,F | 1OB5 | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDM | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | 0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z | 1KQS | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDV | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | 1,2,4,5,6,A, B,C,D,E,J,K, L,M,N,O,P,R, S,T,U,V,Z | 1Q86 | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDY | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 3FIC | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDH | 0.73 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KE2 | 0.73 | ![]() |
KHA![]() | 1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)- 1-METHYLPIPERIDINIUM | H,L,X,Y | 1UWG | 0.71 | ![]() |
RXA![]() | isoquinoline-1,3,4(2H)-trione | A,B,C,D | 3DEH | 0.75 | ![]() |
DMW![]() | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.71 | ![]() |
BSA![]() | 2-(BENZOYLAMINO)ETHANESULFONIC ACID | A | 1YQS | 0.74 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D | 2BTJ | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D,E,F | 2EFX | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D | 2VVJ | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A | 2A4O | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B | 1XAE | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D | 2OGR | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D | 1QA7 | 0.77 | ![]() |
NFA![]() | PHENYLALANINE AMIDE | A,B,C,D | 2GW4 | 0.77 | ![]() |
ABN![]() | BENZYLAMINE | D,H | 2HXC | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A,I | 1A86 | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTN | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6X | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 2BZA | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 2EUS | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6Y | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTJ | 0.74 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1GT5 | 0.75 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1DZP | 0.75 | ![]() |
HBD![]() | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.74 | ![]() |
PHM![]() | PHENYLALANYLMETHANE | A,I | 1PJP | 0.74 | ![]() |
PHM![]() | PHENYLALANYLMETHANE | A,B,C | 2J9J | 0.74 | ![]() |
PHM![]() | PHENYLALANYLMETHANE | A,B,C | 2JE4 | 0.74 | ![]() |
BSB![]() | N-BENZYL-4-SULFAMOYL-BENZAMIDE | A | 1G4O | 0.72 | ![]() |
LEG![]() | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.75 | ![]() |
SAB![]() | 4-SULFONAMIDE-[1-(4-AMINOBUTANE)]BENZAMIDE | A | 1OKM | 0.72 | ![]() |
S2D![]() | N-BENZOYL-D-ALANINE | A,B | 2JCI | 0.73 | ![]() |
DBZ![]() | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SN9 | 0.72 | ![]() |
DBZ![]() | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1SNE | 0.72 | ![]() |
DBZ![]() | 3-(BENZOYLAMINO)-L-ALANINE | A,B,C,D | 1SNA | 0.72 | ![]() |
DBZ![]() | 3-(BENZOYLAMINO)-L-ALANINE | A,B | 1XOF | 0.72 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | D,H | 2I0S | 0.71 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.71 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.71 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.71 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6U | 0.71 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A | 1HSR | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A | 3GCK | 0.94 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.94 | ![]() |
BAG![]() | N-[(E)-2-AMINO-1-(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)- 2-HYDROXYVINYL]BENZAMIDE | A | 1WDA | 0.7 | ![]() |
4PI![]() | N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE | A,B | 2NSD | 0.74 | ![]() |
SP8![]() | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNS | 0.8 | ![]() |