Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03275933
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 |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.71 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.73 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.73 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.73 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.73 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.73 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.77 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.7 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.7 | |
HZH | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.71 | |
BDB | A,B | 1KE3 | 0.73 | ||
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.73 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.79 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.79 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.75 | |
HPQ | HOMOPHENYLALANINYLMETHANE | B | 1EWP | 0.7 | |
FEP | [(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)- PHENYL]-BUTYL}-PHENYL)-DIFLUORO- METHYL]-PHOSPHONIC ACID | A | 1KAV | 0.71 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.75 | |
FLP | FLURBIPROFEN | A,B | 1CQE | 0.75 | |
FLP | FLURBIPROFEN | A,B | 1EQH | 0.75 | |
FLP | FLURBIPROFEN | A,B | 2AYL | 0.75 | |
FLP | FLURBIPROFEN | A | 1DVT | 0.75 | |
FLP | FLURBIPROFEN | A | 1R9O | 0.75 | |
IBP | IBUPROFEN | A | 3FKX | 0.72 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.72 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.72 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.72 | |
IBP | IBUPROFEN | A | 2PWS | 0.72 | |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.78 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.76 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.76 | |
VK3 | MENADIONE | A | 1TUV | 0.75 | |
VK3 | MENADIONE | A,B | 2QR2 | 0.75 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.71 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.71 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.71 | |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.78 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 3D38 | 0.76 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 1VRN | 0.76 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 2I5N | 0.76 | |
MQ9 | MENAQUINONE-9 | C,H,L,M,U | 1DXR | 0.76 | |
1PB | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.73 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.76 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.77 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1PRC | 0.76 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,P | 2B76 | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 5PRC | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 7PRC | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2PRC | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1R2C | 0.76 | |
MQ7 | MENAQUINONE-7 | A,B,C,E,F,G | 2VPW | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 3PRC | 0.76 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,O,P | 1L0V | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2JBL | 0.76 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 6PRC | 0.76 | |
PQN | PHYLLOQUINONE | A,B,C,F,I,J, K,L,M,X | 1JB0 | 0.78 | |
PQN | PHYLLOQUINONE | 1,2,3,4,A,B, C,F,G,H,I,J, K,L | 2O01 | 0.78 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 2PPS | 0.78 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 1C51 | 0.78 | |
PQN | PHYLLOQUINONE | 0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z | 1QZV | 0.78 | |
825 | [{2-bromo-4-[(2R)-3-oxo-2,3-diphenylpropyl]phenyl}(difluoro)methyl]phosphonic acid | A | 3CWE | 0.71 | |
ANQ | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.73 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
3PL | 3-PHENYLPROPANAL | E | 1Y3G | 0.74 | |
BFL | A,B | 1Q4G | 0.74 | ||
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.71 | |
MQ8 | MENAQUINONE 8 | C,H,L,M | 1EYS | 0.76 |