Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02303266
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 |
267 | 1-(azidomethyl)-3-methylbenzene | A | 2RBQ | 0.76 | |
BEN | BENZAMIDINE | A | 2TIO | 0.7 | |
BEN | BENZAMIDINE | A | 1J15 | 0.7 | |
BEN | BENZAMIDINE | A,B | 3BEU | 0.7 | |
BEN | BENZAMIDINE | T | 1V2U | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3CF8 | 0.7 | |
BEN | BENZAMIDINE | A | 1S0R | 0.7 | |
BEN | BENZAMIDINE | A,B | 1V16 | 0.7 | |
BEN | BENZAMIDINE | A | 1CC7 | 0.7 | |
BEN | BENZAMIDINE | A | 3BG8 | 0.7 | |
BEN | BENZAMIDINE | A | 1CC8 | 0.7 | |
BEN | BENZAMIDINE | A | 3PTB | 0.7 | |
BEN | BENZAMIDINE | A,B | 1TRM | 0.7 | |
BEN | BENZAMIDINE | A | 1ZHR | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 1NKZ | 0.7 | |
BEN | BENZAMIDINE | A | 2BLV | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLP | 0.7 | |
BEN | BENZAMIDINE | H,I | 3D49 | 0.7 | |
BEN | BENZAMIDINE | H,L,T | 2AER | 0.7 | |
BEN | BENZAMIDINE | A | 1J14 | 0.7 | |
BEN | BENZAMIDINE | A | 1NSA | 0.7 | |
BEN | BENZAMIDINE | A | 2AYW | 0.7 | |
BEN | BENZAMIDINE | A | 1BRA | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D | 1A0J | 0.7 | |
BEN | BENZAMIDINE | B,C,D | 2AST | 0.7 | |
BEN | BENZAMIDINE | A,B | 2CKR | 0.7 | |
BEN | BENZAMIDINE | A | 1LPU | 0.7 | |
BEN | BENZAMIDINE | A | 1ZHM | 0.7 | |
BEN | BENZAMIDINE | A | 1J8A | 0.7 | |
BEN | BENZAMIDINE | A,B | 3BCX | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3CF9 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3D04 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLL | 0.7 | |
BEN | BENZAMIDINE | A | 1AND | 0.7 | |
BEN | BENZAMIDINE | A | 2TBS | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP2 | 0.7 | |
BEN | BENZAMIDINE | T | 1V2M | 0.7 | |
BEN | BENZAMIDINE | A | 2EEK | 0.7 | |
BEN | BENZAMIDINE | H,I | 2ZI2 | 0.7 | |
BEN | BENZAMIDINE | T | 1V2J | 0.7 | |
BEN | BENZAMIDINE | H | 1KLI | 0.7 | |
BEN | BENZAMIDINE | A | 1CE5 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3B7J | 0.7 | |
BEN | BENZAMIDINE | B,Y | 2PKA | 0.7 | |
BEN | BENZAMIDINE | A | 2VJ0 | 0.7 | |
BEN | BENZAMIDINE | A | 3B3J | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DOY | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP3 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLM | 0.7 | |
BEN | BENZAMIDINE | A | 1ANB | 0.7 | |
BEN | BENZAMIDINE | A | 1LO6 | 0.7 | |
BEN | BENZAMIDINE | A | 1LR4 | 0.7 | |
BEN | BENZAMIDINE | A,B | 1V1M | 0.7 | |
BEN | BENZAMIDINE | A | 1ZHP | 0.7 | |
BEN | BENZAMIDINE | A | 2J9N | 0.7 | |
BEN | BENZAMIDINE | A | 2BMV | 0.7 | |
BEN | BENZAMIDINE | A,B | 2CKS | 0.7 | |
BEN | BENZAMIDINE | A | 2BLW | 0.7 | |
BEN | BENZAMIDINE | A | 1J16 | 0.7 | |
BEN | BENZAMIDINE | A,B | 1V11 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP0 | 0.7 | |
BEN | BENZAMIDINE | B | 1RTF | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP1 | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D | 2E58 | 0.7 | |
BEN | BENZAMIDINE | A | 2TRM | 0.7 | |
BEN | BENZAMIDINE | T | 1V2V | 0.7 | |
BEN | BENZAMIDINE | A | 1MBQ | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DOZ | 0.7 | |
BEN | BENZAMIDINE | A | 2O8U | 0.7 | |
BEN | BENZAMIDINE | H | 1DWB | 0.7 | |
BEN | BENZAMIDINE | B,C | 2ASS | 0.7 | |
BEN | BENZAMIDINE | A | 1ANE | 0.7 | |
BEN | BENZAMIDINE | H,I | 2ZIQ | 0.7 | |
BEN | BENZAMIDINE | A | 1BIT | 0.7 | |
BEN | BENZAMIDINE | A | 2AIQ | 0.7 | |
BEN | BENZAMIDINE | A | 2OQ5 | 0.7 | |
BEN | BENZAMIDINE | A | 1ANC | 0.7 | |
BEN | BENZAMIDINE | H | 1JBU | 0.7 | |
BEN | BENZAMIDINE | A,B | 2BPQ | 0.7 | |
BEN | BENZAMIDINE | A,B,C,D | 2GNN | 0.7 | |
BEN | BENZAMIDINE | T | 1V2S | 0.7 | |
BEN | BENZAMIDINE | A | 1H4W | 0.7 | |
BEN | BENZAMIDINE | A | 1OSS | 0.7 | |
BEN | BENZAMIDINE | A | 1W80 | 0.7 | |
BEN | BENZAMIDINE | A | 1BTY | 0.7 | |
BEN | BENZAMIDINE | H,I | 2ZFQ | 0.7 | |
BEN | BENZAMIDINE | A | 1EAX | 0.7 | |
BEN | BENZAMIDINE | A | 1L2E | 0.7 | |
BEN | BENZAMIDINE | A | 1WRI | 0.7 | |
BEN | BENZAMIDINE | A,B | 3BB8 | 0.7 | |
BEN | BENZAMIDINE | A | 2OXS | 0.7 | |
BEN | BENZAMIDINE | A | 1DPO | 0.7 | |
BEN | BENZAMIDINE | T | 1V2L | 0.7 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.73 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.73 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.77 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.77 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.73 | |
1PC | 1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE | B,C | 2PCP | 0.75 | |
PMI | (2-AMINO-2,3-DIHYDRO-1H-INDEN-2- YL)PHOSPHONIC ACID | A,B,C,D,E,F, G,H | 2O7E | 0.79 | |
GVQ | (2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE | A | 2UW8 | 0.73 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.78 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.78 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.78 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.78 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.77 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.77 | |
RMA | N-[(1S)-2,3-DIHYDRO-1H-INDEN-1- YL]-N-METHYL-N-PROP-2-YNYLAMINE | A,B | 1S3B | 0.78 | |
RAS | N-PROPARGYL-1(R)-AMINONDAN | A,B | 2BK4 | 0.79 | |
RAS | N-PROPARGYL-1(R)-AMINONDAN | A,B | 1S2Q | 0.79 | |
ANC | ANTHRACEN-1-YLAMINE | A,B | 1GT1 | 0.73 | |
ANC | ANTHRACEN-1-YLAMINE | A,B | 1HN2 | 0.73 | |
RM1 | N-METHYL-1(R)-AMINOINDAN | A,B | 2C67 | 0.84 | |
IDI | 7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE | A,B | 1N7J | 0.72 | |
BZZ | BENZYLHYDRAZINE | A,B | 2E2V | 0.7 | |
DPK | DEPRENYL | A,B | 2BYB | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.74 | |
ISO | PARA-ISOPROPYLANILINE | A | 1BMA | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.78 | |
B2Y | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.86 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.77 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.77 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.71 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.78 | |
9AP | 9-AMINOPHENANTHRENE | A | 1EGY | 0.73 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.72 | |
OXE | ORTHO-XYLENE | A | 188L | 0.72 | |
TPA | TRANS-2-PHENYLCYCLOPROPYLAMINE | A | 1TNL | 0.76 | |
FBA | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.74 | |
FBA | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.74 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.76 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C73 | 0.79 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 1S2Y | 0.79 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C75 | 0.79 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C76 | 0.79 | |
RSA | N-PROPARGYL-1(S)-AMINOINDAN | A,B | 2C72 | 0.79 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.74 | |
AFF | 2-ACETYLAMINOFLUORENE-3-YL | A | 2GE2 | 0.74 | |
BAM | BENZAMIDINE | U | 1F5K | 0.7 | |
BAM | BENZAMIDINE | X | 2BY8 | 0.7 | |
BAM | BENZAMIDINE | B | 2PSM | 0.7 | |
BAM | BENZAMIDINE | X | 2BY9 | 0.7 | |
BAM | BENZAMIDINE | A | 1C1N | 0.7 | |
BAM | BENZAMIDINE | X | 2BY6 | 0.7 | |
BAM | BENZAMIDINE | H,I | 1C5O | 0.7 | |
BAM | BENZAMIDINE | A | 1XX4 | 0.7 | |
BAM | BENZAMIDINE | A | 1HJ8 | 0.7 | |
BAM | BENZAMIDINE | A | 1C5P | 0.7 | |
BAM | BENZAMIDINE | B | 1C5Z | 0.7 | |
BAM | BENZAMIDINE | A,B | 1ZVW | 0.7 | |
BAM | BENZAMIDINE | A | 2ANW | 0.7 | |
BAM | BENZAMIDINE | A | 2ANY | 0.7 | |
BAM | BENZAMIDINE | X | 2BYA | 0.7 | |
BAM | BENZAMIDINE | A | 1TIO | 0.7 | |
BAM | BENZAMIDINE | X | 2BY5 | 0.7 | |
BAM | BENZAMIDINE | X | 2BY7 | 0.7 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.71 | |
007 | 1-METHYLAMINE-1-BENZYL-CYCLOPENTANE | A,B,C,D | 2BUA | 0.77 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.75 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.75 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.78 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.78 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.75 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.75 | |
1PB | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.7 | |
263 | 1-(azidomethyl)-3-methylbenzene | X | 2RB2 | 0.76 | |
DEN | INDENE | A | 183L | 0.71 | |
ABN | BENZYLAMINE | D,H | 2HXC | 0.77 | |
ABN | BENZYLAMINE | A,I | 1A86 | 0.77 | |
ABN | BENZYLAMINE | A | 1UTN | 0.77 | |
ABN | BENZYLAMINE | A | 1N6X | 0.77 | |
ABN | BENZYLAMINE | A | 2BZA | 0.77 | |
ABN | BENZYLAMINE | A | 2EUS | 0.77 | |
ABN | BENZYLAMINE | A | 1N6Y | 0.77 | |
ABN | BENZYLAMINE | A | 1UTJ | 0.77 | |
BDB | A,B | 1KE3 | 0.71 | ||
BHY | N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide | A,B | 3BBR | 0.7 | |
NPY | NAPHTHALENE | A,B | 1O7G | 0.71 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | E,F,G,H | 1NJU | 0.71 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | Y,Z | 1JQ7 | 0.71 | |
BAS | N-(1-PHENYL-PROPYL)-FORMAMIDE | C | 1NKM | 0.71 |