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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3977 | 501-30-4 |
| Molecule | Description |
|---|---|
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Synonyms:
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | -1.425 | Moderate | 0.67 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 1.429 | Moderate | 0.67 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 8.222 | 10^-6 cm/s | Moderate | 0.67 |
| dh-clint | Dog hepatocyte intrinsic clearance | 1.652 | uL/min/10^6 cells | Moderate | 0.67 |
| dppb | Dog plasma protein binding (% unbound) | 75.470 | % | Moderate | 0.67 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 77.780 | % | Moderate | 0.67 |
| herg | hERG pIC50 | 4.127 | pIC50 | Moderate | 0.67 |
| hh-clint | Human hepatocyte intrinsic clearance | 2.612 | uL/min/10^6 cells | Moderate | 0.67 |
| hlm-clint | Human liver microsomal intrinsic clearance | 3.228 | uL/min/mg protein | Moderate | 0.67 |
| hppb | Human plasma protein binding (% unbound) | 60.820 | % | Moderate | 0.67 |
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,ALK,AURKA,AURKB,AURKC,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK1,CDK2,CDK4,CDK5,CDK9,CHEK1,CSF1R,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GRK3,GSK3B,IGF1R,IKBKB,IRAK1,ITK,JAK1,JAK2,JAK3,KDR,KIT,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAP4K1,MAP4K3,MAPK1,MAPK10,MAPK12,MAPK7,MAPK8,MAPK9,MAPKAPK2,MARK4,MTOR,NTRK2,PAK4,PDK1,PDK2,PDK4,PDPK1,PIK3CB,PIK3CD,PIM1,PIM2,PLK1,PLK2,PLK3,PLK4,PRKCD,PRKDC,PTK2,SGK1,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ULK2,ZAP70 | 81 | |||
| kinase-selectivity-class | ACVR2A,ACVR2B,ACVRL1,AURKB,AXL,BMX,BRAF,CAMK2B,CAMK2D,CDK4,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,GSK3B,IRAK1,JAK2,KIT,MAP2K6,MAP3K14,MAPK1,MAPK12,MAPK7,MAPK8,MARK4,PIK3CA,PRKDC,SIK2,STK33,SYK,TEK,TGFBR1,TTK | 36 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.133 | Moderate | 0.67 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 31.915 | Moderate | 0.67 | |
| mppb | Mouse plasma protein binding (% unbound) | 87.570 | Moderate | 0.67 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 1.199 | Moderate | 0.67 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 53.510 | % | Moderate | 0.67 |
| rh-clint | Rat hepatocyte intrinsic clearance | 11.885 | uL/min/10^6 cells | Moderate | 0.67 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 97.360 | % | Moderate | 0.67 |
| rppb | Rat plasma protein binding (% unbound) | 46.320 | % | Moderate | 0.67 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 1142.878 | uM | Moderate | 0.67 |
None
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| Source | Code | Description |
|---|---|---|
| MeSH PA | D000975 | Antioxidants |
| MeSH PA | D020011 | Protective Agents |
| CHEBI has role | CHEBI:59997 | EC 1.14.18.1 (tyrosinase) inhibitor |
| CHEBI has role | CHEBI:73240 | NF-ÎșB inhibitor |
| CHEBI has role | CHEBI:76956 | <em>Aspergillus </em> metabolite |
| CHEBI has role | CHEBI:85046 | skin lightening agent |
| CHEBI has role | CHEBI:85049 | EC 1.10.3.1 (catechol oxidase) inhibitor |
| CHEBI has role | CHEBI:85050 | EC 1.10.3.2 (laccase) inhibitor |
| CHEBI has role | CHEBI:85051 | EC 1.13.11.24 (quercetin 2,3-dioxygenase) inhibitor |
| CHEBI has role | CHEBI:85052 | EC 1.4.3.3 (<small>D</small>-amino-acid oxidase) inhibitor |
None
None
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.13 | acidic |
| pKa2 | 12.5 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Tyrosinase | Enzyme | IC50 | 5.13 | CHEMBL | |||||
| D-amino-acid oxidase | Enzyme | IC50 | 5.70 | CHEMBL | |||||
| Polyphenol oxidase 2 | Enzyme | Ki | 4.65 | CHEMBL | |||||
| D-amino-acid oxidase | Enzyme | Ki | 4.68 | CHEMBL | |||||
| Tyrosinase | Enzyme | IC50 | 4.21 | CHEMBL | |||||
| Polymerase acidic protein | Enzyme | IC50 | 4.91 | CHEMBL | |||||
| Tyrosinase | Enzyme | IC50 | 4.28 | CHEMBL | |||||
| Polyphenol oxidase 1 | Enzyme | IC50 | 4.82 | CHEMBL |
| ID | Source |
|---|---|
| C0064401 | UMLSCUI |
| CHEBI:43572 | CHEBI |
| KOJ | PDB_CHEM_ID |
| CHEMBL287556 | ChEMBL_ID |
| DB01759 | DRUGBANK_ID |
| 3840 | PUBCHEM_CID |
| C011890 | MESH_SUPPLEMENTAL_RECORD_UI |
| 6K23F1TT52 | UNII |
| 1426451 | RXNORM |
| NOCODE | MMSL |
| 007822 | NDDF |
| 6K23F1TT52 | INXIGHT DRUGS |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| MELAO Whitening Cream | HUMAN OTC DRUG LABEL | 3 | 74458-134 | CREAM | 0.70 g | TOPICAL | OTC Monograph Drug | 10 sections |
| GZE KOJIC ACID CORRECTOR SERUM | HUMAN OTC DRUG LABEL | 3 | 74458-315 | CAPSULE | 1.30 g | TOPICAL | OTC Monograph Drug | 10 sections |
| GZE KOJIC ACID TURMERIC CLEANSING PADS | HUMAN OTC DRUG LABEL | 3 | 74458-351 | PATCH | 0.80 g | TOPICAL | OTC Monograph Drug | 11 sections |
| MELAO Kojic Acid BodyLotion | HUMAN OTC DRUG LABEL | 2 | 74458-357 | LOTION | 0.50 g | TOPICAL | OTC Monograph Drug | 10 sections |
| GZE Lemon Turmeric Kojic Acid LiquidSoap | HUMAN OTC DRUG LABEL | 1 | 74458-404 | LIQUID | 0.60 g | TOPICAL | OTC Monograph Drug | 11 sections |
| AnubisMed | HUMAN OTC DRUG LABEL | 14 | 83021-401 | LIQUID | 2.50 g | TOPICAL | OTC monograph final | 9 sections |
| Deodorant Underarms Body Skin | HUMAN OTC DRUG LABEL | 1 | 84019-008 | PASTE | 1 g | CUTANEOUS | OTC Monograph Drug | 11 sections |
| Kojic Acid Turmeric Cleansing Pads | HUMAN OTC DRUG LABEL | 1 | 84019-015 | CLOTH | 100 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| TurmericKojicSoap | HUMAN OTC DRUG LABEL | 1 | 84019-017 | SOAP | 100 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| KOJIC ACID Cream | HUMAN OTC DRUG LABEL | 2 | 84025-095 | CREAM | 5 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| Firming NeckStick | HUMAN OTC DRUG LABEL | 2 | 84025-102 | CREAM | 5 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| GLYCOLIC ACID PADS | HUMAN OTC DRUG LABEL | 2 | 84025-162 | DRESSING | 5 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| TURMERIC KOJIC ACIDCLEANSINGPADS | HUMAN OTC DRUG LABEL | 2 | 84025-163 | SPONGE | 5 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| Turmeric Facial cleanser | HUMAN OTC DRUG LABEL | 2 | 84025-185 | LIQUID | 3 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| Kojic acid and turmeric interface pad | HUMAN OTC DRUG LABEL | 2 | 84025-299 | SWAB | 3 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| remove black milk cream | HUMAN OTC DRUG LABEL | 2 | 84025-307 | CREAM | 5 mg | CUTANEOUS | OTC Monograph Drug | 5 sections |
| Whitening Turmeric Oil | HUMAN OTC DRUG LABEL | 2 | 84423-003 | OIL | 0.40 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| Glutathione And Kojic Atid Exfoliating BlackSoap | HUMAN OTC DRUG LABEL | 3 | 84423-011 | SOAP | 0.25 mg | CUTANEOUS | OTC Monograph Drug | 9 sections |
| Whitening ExfoliatingSoap | HUMAN OTC DRUG LABEL | 2 | 84423-012 | SOAP | 1.25 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| MIRACLE SUPER WHITE BODYLOTION | HUMAN OTC DRUG LABEL | 5 | 84423-031 | EMULSION | 4 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| 7Days Advanced Whitening BodyLotion | HUMAN OTC DRUG LABEL | 3 | 84423-032 | EMULSION | 5 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| strong whitening bodylotion | HUMAN OTC DRUG LABEL | 4 | 84423-045 | EMULSION | 2.50 mg | CUTANEOUS | OTC Monograph Drug | 8 sections |
| ULTIMATE WHITENING BODYLOTION | HUMAN OTC DRUG LABEL | 3 | 84423-047 | EMULSION | 5 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| Motherrepairoil | HUMAN OTC DRUG LABEL | 3 | 84423-050 | EXTRACT | 0.40 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| Morocco Argan Oil | HUMAN OTC DRUG LABEL | 3 | 84423-051 | OIL | 0.40 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| StrongWhiteningSoap | HUMAN OTC DRUG LABEL | 5 | 84423-053 | SOAP | 0.25 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| RetinolOil | HUMAN OTC DRUG LABEL | 3 | 84423-059 | OIL | 0.40 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| KnucklePeelingCream | HUMAN OTC DRUG LABEL | 6 | 84423-063 | CREAM, AUGMENTED | 0.05 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| KNUCKLEPEELINGBODYOIL | HUMAN OTC DRUG LABEL | 2 | 84423-065 | CREAM, AUGMENTED | 2.50 g | CUTANEOUS | OTC Monograph Drug | 8 sections |
| Super Lightening Based on Gold 24k and Kojic Acid Cream | HUMAN OTC DRUG LABEL | 6 | 84423-068 | CREAM, AUGMENTED | 0.50 g | CUTANEOUS | OTC Monograph Drug | 8 sections |