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FOLIC ACID CHEBI:569217::Folacin::Folic Acid

Data: 2 KI  3 IC50  3 Kd

PDB links: 46 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match
png missing

Other Databases links: PubChem cid PubChem sid

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50367343    Zinc 0: unavailable per Zinc DB. Zinc 1: purchasable, 2 weeks to supply. Zinc 2: made on demand. Zinc 4: potentially available
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Solute carrier organic anion transporter family member 1A3


(Rattus norvegicus)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
UniProtKB/SwissProt

GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
PubMed
14100.0n/an/an/an/an/an/an/an/a



Kyoto University Hospital

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of MTX uptake in OAT-K1-expressing MDCK cells


J Pharmacol Exp Ther 293: 1034-9 (2000)

More data for this
Ligand-Target Pair
Thymidylate Synthase (TS)


(Homo sapiens)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
Article
PubMed
40000.0n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory constant of thymidylate synthase was determined in human AML cells


Citation and Details

More data for this
Ligand-Target Pair
Dihydrofolate Reductase (DHFR)


(Homo sapiens)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
PDB
Article
PubMed
n/an/an/a 4800n/an/an/an/an/a



Pennsylvania State University

Curated by ChEMBL


Assay Description
Thermodynamic Dissociation Constant for compound-Val31-dihydrofolate reductase (DHFR) complex at pH 7


Citation and Details

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Thymidylate synthase


(Mus musculus)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
Article
PubMed
n/an/a>1000000.0n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against thymidylate synthase in the intact L1210 cells


Citation and Details

More data for this
Ligand-Target Pair
Thymidylate Synthase (TS)


(Homo sapiens)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
Article
PubMed
n/an/a 290000.0n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit thymidylate synthase derived from human leukemia K562 cells


Citation and Details

More data for this
Ligand-Target Pair
Dihydrofolate Reductase (DHFR)


(Homo sapiens)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
PDB
Article
PubMed
n/an/an/a 810n/an/an/an/an/a



Pennsylvania State University

Curated by ChEMBL


Assay Description
Thermodynamic Dissociation Constant for compound-Phe31-dihydrofolate reductase (DHFR) complex at pH 7


Citation and Details

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dihydrofolate Reductase (DHFR)


(Homo sapiens)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
PDB
Article
PubMed
n/an/an/a 4400n/an/an/an/an/a



Pennsylvania State University

Curated by ChEMBL


Assay Description
Thermodynamic Dissociation Constant for compound-Tyr31-dihydrofolate reductase (DHFR) complex at pH 7


Citation and Details

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Thymidylate synthase


(Mus musculus)
FOLIC ACID
PNG
(CHEBI:569217 | Folacin | Folic Acid)
Show SMILES Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2[nH]1 |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
DrugBank
PC cid
PC sid
PDB

Similars

AffyNet 
Article
PubMed
n/an/a 180000.0n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against the thymidylate synthase in the Permeabilized L1210 cells


Citation and Details

More data for this
Ligand-Target Pair