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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02100783

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MNS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDEA1OKL0.72
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.73
6756-[(Z)-AMINO(IMINO)METHYL]-N-PHENYL-
2-NAPHTHAMIDE
A1OWE0.72
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B3CFN0.75
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B2ANS0.75
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B1OW40.75
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA1EYN0.75
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B1TXC0.75
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QJU0.72
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QB40.72
34A3,4-DIMETHYLANILINEA1L4K0.72
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.7
XYD2,5-DIMETHYLANILINEA1L4L0.7
ISOPARA-ISOPROPYLANILINEA1BMA0.7
ISOPARA-ISOPROPYLANILINEA,B1ELC0.7
ISOPARA-ISOPROPYLANILINEA,B1ELB0.7
ISOPARA-ISOPROPYLANILINEA,B1ELA0.7
9AP9-AMINOPHENANTHRENEA1EGY0.85
4PG1-[4-(2-oxo-2-phenylethyl)phenyl]guanidineU2R2W0.7
URSN-PHENYLTHIOUREAA,B1BUG0.75
ANCANTHRACEN-1-YLAMINEA,B1GT10.84
ANCANTHRACEN-1-YLAMINEA,B1HN20.84
MC2N2-(L-PHENYLALANYL)-N1-(NAPHTHALENYL)-
L-ARIGNINAMIDE
A1T9Y0.7
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.74
2396-[(Z)-AMINO(IMINO)METHYL]-N-[4-
(AMINOMETHYL)PHENYL]-2-NAPHTHAMIDE
A1OWH0.7
BSU1,3-DIPHENYLUREAA3E850.72
BSU1,3-DIPHENYLUREAA2ZJF0.72