Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02806283
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 |
U19 | 5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG5 | 0.71 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.78 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.78 | |
ISO | PARA-ISOPROPYLANILINE | A | 1BMA | 0.73 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.73 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.73 | |
ISO | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.73 | |
APA | AMIDO PHENYL PYRUVIC ACID | H,I | 1AHT | 0.7 | |
APA | AMIDO PHENYL PYRUVIC ACID | A,B,C,D | 1A0L | 0.7 | |
APA | AMIDO PHENYL PYRUVIC ACID | A | 1TPP | 0.7 | |
BZZ | BENZYLHYDRAZINE | A,B | 2E2V | 0.73 | |
34A | 3,4-DIMETHYLANILINE | A | 1L4K | 0.74 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.72 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.72 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.73 | |
OXE | ORTHO-XYLENE | A | 188L | 0.73 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.75 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.75 | |
BAM | BENZAMIDINE | U | 1F5K | 0.94 | |
BAM | BENZAMIDINE | X | 2BY8 | 0.94 | |
BAM | BENZAMIDINE | B | 2PSM | 0.94 | |
BAM | BENZAMIDINE | X | 2BY9 | 0.94 | |
BAM | BENZAMIDINE | A | 1C1N | 0.94 | |
BAM | BENZAMIDINE | X | 2BY6 | 0.94 | |
BAM | BENZAMIDINE | H,I | 1C5O | 0.94 | |
BAM | BENZAMIDINE | A | 1XX4 | 0.94 | |
BAM | BENZAMIDINE | A | 1HJ8 | 0.94 | |
BAM | BENZAMIDINE | A | 1C5P | 0.94 | |
BAM | BENZAMIDINE | B | 1C5Z | 0.94 | |
BAM | BENZAMIDINE | A,B | 1ZVW | 0.94 | |
BAM | BENZAMIDINE | A | 2ANW | 0.94 | |
BAM | BENZAMIDINE | A | 2ANY | 0.94 | |
BAM | BENZAMIDINE | X | 2BYA | 0.94 | |
BAM | BENZAMIDINE | A | 1TIO | 0.94 | |
BAM | BENZAMIDINE | X | 2BY5 | 0.94 | |
BAM | BENZAMIDINE | X | 2BY7 | 0.94 | |
MFG | (1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN- 1-IMINE | A,B | 2VZ2 | 0.73 | |
SBZ | [4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINE | A | 1S85 | 0.74 | |
FBA | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.75 | |
FBA | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.75 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.73 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.7 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.7 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.7 | |
4BZ | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.74 | |
RM1 | N-METHYL-1(R)-AMINOINDAN | A,B | 2C67 | 0.73 | |
BBA | 2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE | A,B | 1A5H | 0.75 | |
BBA | 2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE | T | 1V2N | 0.75 | |
CGQ | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B,D,E | 2G0E | 0.75 | |
CGQ | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B | 1M6F | 0.75 | |
263 | 1-(azidomethyl)-3-methylbenzene | X | 2RB2 | 0.77 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A | 1QWC | 0.77 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1FOI | 0.77 | |
14W | N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE | A,B | 1QW5 | 0.77 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.73 | |
TPA | TRANS-2-PHENYLCYCLOPROPYLAMINE | A | 1TNL | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.75 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.75 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.75 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.75 | |
150 | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.72 | |
U12 | 5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG2 | 0.71 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.75 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.75 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | H,I | 1C5N | 0.7 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5R | 0.7 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5Q | 0.7 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1O5B | 0.7 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5X | 0.7 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5W | 0.7 | |
IN4 | +/-METHYL 4-(AMINOIMINOMETHYL)- BETA-[3- INH (AMINOIMINO)PHENYL]BENZENE PENTANOATE | A | 1AZ8 | 0.71 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.75 | |
ESX | BENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5S | 0.73 | |
007 | 1-METHYLAMINE-1-BENZYL-CYCLOPENTANE | A,B,C,D | 2BUA | 0.72 | |
745 | TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE- 2-CARBOXAMIDINE | A | 1U6Q | 0.8 | |
BEN | BENZAMIDINE | A | 2TIO | 0.94 | |
BEN | BENZAMIDINE | A | 1J15 | 0.94 | |
BEN | BENZAMIDINE | A,B | 3BEU | 0.94 | |
BEN | BENZAMIDINE | T | 1V2U | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3CF8 | 0.94 | |
BEN | BENZAMIDINE | A | 1S0R | 0.94 | |
BEN | BENZAMIDINE | A,B | 1V16 | 0.94 | |
BEN | BENZAMIDINE | A | 1CC7 | 0.94 | |
BEN | BENZAMIDINE | A | 3BG8 | 0.94 | |
BEN | BENZAMIDINE | A | 1CC8 | 0.94 | |
BEN | BENZAMIDINE | A | 3PTB | 0.94 | |
BEN | BENZAMIDINE | A,B | 1TRM | 0.94 | |
BEN | BENZAMIDINE | A | 1ZHR | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 1NKZ | 0.94 | |
BEN | BENZAMIDINE | A | 2BLV | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLP | 0.94 | |
BEN | BENZAMIDINE | H,I | 3D49 | 0.94 | |
BEN | BENZAMIDINE | H,L,T | 2AER | 0.94 | |
BEN | BENZAMIDINE | A | 1J14 | 0.94 | |
BEN | BENZAMIDINE | A | 1NSA | 0.94 | |
BEN | BENZAMIDINE | A | 2AYW | 0.94 | |
BEN | BENZAMIDINE | A | 1BRA | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D | 1A0J | 0.94 | |
BEN | BENZAMIDINE | B,C,D | 2AST | 0.94 | |
BEN | BENZAMIDINE | A,B | 2CKR | 0.94 | |
BEN | BENZAMIDINE | A | 1LPU | 0.94 | |
BEN | BENZAMIDINE | A | 1ZHM | 0.94 | |
BEN | BENZAMIDINE | A | 1J8A | 0.94 | |
BEN | BENZAMIDINE | A,B | 3BCX | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3CF9 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3D04 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLL | 0.94 | |
BEN | BENZAMIDINE | A | 1AND | 0.94 | |
BEN | BENZAMIDINE | A | 2TBS | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP2 | 0.94 | |
BEN | BENZAMIDINE | T | 1V2M | 0.94 | |
BEN | BENZAMIDINE | A | 2EEK | 0.94 | |
BEN | BENZAMIDINE | H,I | 2ZI2 | 0.94 | |
BEN | BENZAMIDINE | T | 1V2J | 0.94 | |
BEN | BENZAMIDINE | H | 1KLI | 0.94 | |
BEN | BENZAMIDINE | A | 1CE5 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3B7J | 0.94 | |
BEN | BENZAMIDINE | B,Y | 2PKA | 0.94 | |
BEN | BENZAMIDINE | A | 2VJ0 | 0.94 | |
BEN | BENZAMIDINE | A | 3B3J | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DOY | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP3 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 2GLM | 0.94 | |
BEN | BENZAMIDINE | A | 1ANB | 0.94 | |
BEN | BENZAMIDINE | A | 1LO6 | 0.94 | |
BEN | BENZAMIDINE | A | 1LR4 | 0.94 | |
BEN | BENZAMIDINE | A,B | 1V1M | 0.94 | |
BEN | BENZAMIDINE | A | 1ZHP | 0.94 | |
BEN | BENZAMIDINE | A | 2J9N | 0.94 | |
BEN | BENZAMIDINE | A | 2BMV | 0.94 | |
BEN | BENZAMIDINE | A,B | 2CKS | 0.94 | |
BEN | BENZAMIDINE | A | 2BLW | 0.94 | |
BEN | BENZAMIDINE | A | 1J16 | 0.94 | |
BEN | BENZAMIDINE | A,B | 1V11 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP0 | 0.94 | |
BEN | BENZAMIDINE | B | 1RTF | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DP1 | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D | 2E58 | 0.94 | |
BEN | BENZAMIDINE | A | 2TRM | 0.94 | |
BEN | BENZAMIDINE | T | 1V2V | 0.94 | |
BEN | BENZAMIDINE | A | 1MBQ | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D,E,F | 3DOZ | 0.94 | |
BEN | BENZAMIDINE | A | 2O8U | 0.94 | |
BEN | BENZAMIDINE | H | 1DWB | 0.94 | |
BEN | BENZAMIDINE | B,C | 2ASS | 0.94 | |
BEN | BENZAMIDINE | A | 1ANE | 0.94 | |
BEN | BENZAMIDINE | H,I | 2ZIQ | 0.94 | |
BEN | BENZAMIDINE | A | 1BIT | 0.94 | |
BEN | BENZAMIDINE | A | 2AIQ | 0.94 | |
BEN | BENZAMIDINE | A | 2OQ5 | 0.94 | |
BEN | BENZAMIDINE | A | 1ANC | 0.94 | |
BEN | BENZAMIDINE | H | 1JBU | 0.94 | |
BEN | BENZAMIDINE | A,B | 2BPQ | 0.94 | |
BEN | BENZAMIDINE | A,B,C,D | 2GNN | 0.94 | |
BEN | BENZAMIDINE | T | 1V2S | 0.94 | |
BEN | BENZAMIDINE | A | 1H4W | 0.94 | |
BEN | BENZAMIDINE | A | 1OSS | 0.94 | |
BEN | BENZAMIDINE | A | 1W80 | 0.94 | |
BEN | BENZAMIDINE | A | 1BTY | 0.94 | |
BEN | BENZAMIDINE | H,I | 2ZFQ | 0.94 | |
BEN | BENZAMIDINE | A | 1EAX | 0.94 | |
BEN | BENZAMIDINE | A | 1L2E | 0.94 | |
BEN | BENZAMIDINE | A | 1WRI | 0.94 | |
BEN | BENZAMIDINE | A,B | 3BB8 | 0.94 | |
BEN | BENZAMIDINE | A | 2OXS | 0.94 | |
BEN | BENZAMIDINE | A | 1DPO | 0.94 | |
BEN | BENZAMIDINE | T | 1V2L | 0.94 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.81 | |
PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.81 | |
267 | 1-(azidomethyl)-3-methylbenzene | A | 2RBQ | 0.77 | |
DPK | DEPRENYL | A,B | 2BYB | 0.7 | |
BRN | BERENIL | A,B | 268D | 0.74 | |
BRN | BERENIL | A,B | 1D63 | 0.74 | |
BRN | BERENIL | A,D,E | 2GBY | 0.74 | |
BRN | BERENIL | A | 2DBE | 0.74 | |
BRN | BERENIL | A | 2GVR | 0.74 | |
ABN | BENZYLAMINE | D,H | 2HXC | 0.78 | |
ABN | BENZYLAMINE | A,I | 1A86 | 0.78 | |
ABN | BENZYLAMINE | A | 1UTN | 0.78 | |
ABN | BENZYLAMINE | A | 1N6X | 0.78 | |
ABN | BENZYLAMINE | A | 2BZA | 0.78 | |
ABN | BENZYLAMINE | A | 2EUS | 0.78 | |
ABN | BENZYLAMINE | A | 1N6Y | 0.78 | |
ABN | BENZYLAMINE | A | 1UTJ | 0.78 | |
PYL | PHENYLETHANE | C | 1B07 | 0.7 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.7 | |
PYL | PHENYLETHANE | A | 1NHB | 0.7 | |
L13 | 4-AMINO-5-(2-METHYLPHENYL)-2,4- DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE | A | 2HB9 | 0.76 | |
4CM | (4-CARBAMIMIDOYLPHENYL)-METHYL- PHOSPHINIC ACID | A | 1TX7 | 0.85 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.7 | |
B2Y | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.79 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.74 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.74 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.74 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.74 | |
AM4 | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE | A | 1TX8 | 0.78 |