Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02184445
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 |
CGQ![]() | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B,D,E | 2G0E | 0.7 | ![]() |
CGQ![]() | 3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)- HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]- IMINOMETHYL]-BENZAMIDINIUM | A,B | 1M6F | 0.7 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.73 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.73 | ![]() |
BRN![]() | BERENIL | A,B | 268D | 0.76 | ![]() |
BRN![]() | BERENIL | A,B | 1D63 | 0.76 | ![]() |
BRN![]() | BERENIL | A,D,E | 2GBY | 0.76 | ![]() |
BRN![]() | BERENIL | A | 2DBE | 0.76 | ![]() |
BRN![]() | BERENIL | A | 2GVR | 0.76 | ![]() |
IET![]() | 1-(4-CYANO-PHENYL)-3-[2-(2,6-DICHLORO- PHENYL)-1-IMINO-ETHYL]-THIOUREA | A | 1S6P | 0.71 | ![]() |
ZAT![]() | 4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE) | A | 2W0J | 0.85 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.72 | ![]() |
IXX![]() | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.71 | ![]() |
GP6![]() | 1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA | A | 1BJU | 0.71 | ![]() |
MGR![]() | MALACHITE GREEN | A,B | 3BQZ | 0.73 | ![]() |
MGR![]() | MALACHITE GREEN | A | 1Q8N | 0.73 | ![]() |
MGR![]() | MALACHITE GREEN | A,B | 3BR0 | 0.73 | ![]() |
MGR![]() | MALACHITE GREEN | A,D,E | 3BTL | 0.73 | ![]() |
MGR![]() | MALACHITE GREEN | A,B,D,E | 3BTC | 0.73 | ![]() |
MGR![]() | MALACHITE GREEN | A,B,D,E | 1JUP | 0.73 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1RFN | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1FIZ | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1FIW | 0.71 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.71 | ![]() |
L13![]() | 4-AMINO-5-(2-METHYLPHENYL)-2,4- DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE | A | 2HB9 | 0.71 | ![]() |
CVI![]() | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.73 | ![]() |