CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

CFam Family Information

CFAM Family ID CFFID3745
Family Name Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-ritalinol Family
No. of Seeds 5 No. of Other Members 12
Family Centroid CFAMM00297077 Functional Category Investigative Drug with Natural Product
Superfamily Sodium-dependent dopamine transporter and Sodium-dependent noradrenaline transporter Binder Superfamily 4
Class Class 2869

Cousin Family NamesSeedsMembers
Sodium-dependent dopamine transporter inhibitor substituted ph... 22 416
Histamine H1 receptor Ligand Terfenadine Family 3 50
Alpha adrenergic receptor Ligand Pseudoephedrine Family 4 96
Muscarinic acetylcholine receptor M1 Ligand Trihexyphenidyl Fa... 14 199
Histamine H1 receptor ligand diphenylpiperidine analog Dipheny... 13 224
Mu-type opioid receptor ligand opiate Methadyl Acetate Family 5 9
Nicotinic acetylcholine receptor Ligand Benztropine Mesylate F... 10 20
Dermatan family 1 11
Pitolisant family 4 24
Fibroblast growth factor receptor Ligand SU5403 Family 8 8
Carbonic anhydrase 1 and Carbonic anhydrase 2 Inhibitor Sulfen... 5 13
Adenosine receptor A3 and D(2) dopamine receptor Ligand (+)-bu... 5 14
Adenosine receptor A3 and Mu-type opioid receptor Ligand GBR-1... 80 110
Cytochrome P450 2D6 Inhibitor Bs 7840 Family 4 9
Potassium voltage-gated channel subfamily A member 5 Ligand 2-... 3 1
Delta-type opioid receptor and Kappa-type opioid receptor Liga... 7 19
Delta-type opioid receptor and Kappa-type opioid receptor Liga... 11 3
Sodium-dependent dopamine transporter and Sodium-dependent nor... 2 11
Potassium voltage-gated channel subfamily H member 2 Ligand [1... 2 23
Glutamate receptor ionotropic, NMDA 2B and Glutamate receptor ... 9 7
Delta-type opioid receptor and Kappa-type opioid receptor Liga... 44 3
Alpha-2A adrenergic receptor and Alpha-2B adrenergic receptor ... 2 7
Sodium-dependent dopamine transporter and Sodium-dependent nor... 5 2
Sodium-dependent dopamine transporter and Sodium-dependent nor... 4 19
Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-n-... 8 30
Vesicular acetylcholine transporter inhibitor BENZOVESAMICOL f... 7 4
Histamine H3 receptor ligand 1-[[4-[4-[(1R)-4-methoxy-1-[(2S)-... 2 0
Glucosylceramidase inhibitor (2R,3S,4S,5R)-2-[2-(2-phenylethyl... 1 2
Vesicular acetylcholine transporter inhibitor 2-Naphthalenol, ... 3 2
Sodium-dependent serotonin transporter and Sodium-dependent no... 8 6
Sigma non-opioid intracellular receptor 1 and 5-hydroxytryptam... 3 12
Vesicular acetylcholine transporter inhibitor (1R,2R)-2-spiro[... 3 2
Squalene synthase inhibitor 3-[2-(4-phenylphenyl)ethynyl]-1-az... 2 1
Sodium-dependent dopamine transporter and Sodium-dependent ser... 2 4
Sodium-dependent noradrenaline transporter and Sodium-dependen... 1 1
Sodium-dependent noradrenaline transporter and Sodium-dependen... 6 4
Sodium-dependent dopamine transporter and Sodium-dependent ser... 2 1
Alpha-1A adrenergic receptor and Transporter ligand AGN-PC-00M... 2 2
Sodium-dependent noradrenaline transporter inhibitor AGN-PC-04... 1 0
D(1A) dopamine receptor and D(3) dopamine receptor ligand (2S,... 5 5
Glycogen phosphorylase, muscle form and Glycogen phosphorylase... 1 0
Nuclear receptor ROR-gamma ligand Bio2_000636 family 3 3
Mu-type opioid receptor ligand CHEMBL2373396 family 2 0
Voltage-dependent N-type calcium channel subunit alpha-1B and ... 1 3
7-phenyl-1,3-diazaadamantan-6-ol NP ZINC32124180 Family 5 0
Putative NP ZINC55525127 Family 1 2


CFAM Mol ID

External ID

Functional Category

Molecule Name
CFAMM00297077 DNC014475 Investigative Drug (+/-)-threo-Ritalinol
CFAMM00297084 DNC013270 Investigative Drug threo-N-ethylritalinol hydrochloride
CFAMM00297076 DNC014470 Investigative Drug (+/-)-threo-N-Ethylritalinol
CFAMM00297087 DNC013267 Investigative Drug threo-ritalinol hydrochloride
CFAMM00297078 DNC014477 Investigative Drug (+/-)-threo-3-Fluororitalinol

Statistics of CFAM Database
 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

48716 visits since 2014 .........

 


Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 
Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543