BI-4394 (Synonyms: MMP13-IN-3)

Name: BI-4394
Brand: MedChemExpress
SKU: HY-124029
Rating: 4.5 (1 reviews)

Cat. No.: HY-124029 Purity: 99.91%: FAQs
Data Sheet SDS COA Handling Instructions

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BI-4394 (MMP13-IN-3) is a potent, selective, and orally active MMP-13 inhibitor (IC₅₀=1 nM) for the potential treatment of osteoarthritis. BI-4394 is >1000 selective over other MMPs.

For research use only. We do not sell to patients.

BI-4394 Chemical Structure

CAS No. : 1222173-37-6

Size	Price	Stock	Quantity
Solid + Solvent (Highly Recommended)
10 mM * 1 mL in DMSO ready for reconstitution	USD 308	In-stock	Estimated Time of Arrival: December 31
Solution
10 mM * 1 mL in DMSO	USD 308	In-stock	Estimated Time of Arrival: December 31
Solid
1 mg	USD 110	In-stock	Estimated Time of Arrival: December 31
5 mg	USD 280	In-stock	Estimated Time of Arrival: December 31
10 mg	USD 450	In-stock	Estimated Time of Arrival: December 31
25 mg	USD 790	In-stock	Estimated Time of Arrival: December 31
50 mg	USD 1100	In-stock	Estimated Time of Arrival: December 31
100 mg	USD 1500	In-stock	Estimated Time of Arrival: December 31
200 mg		Get quote
500 mg		Get quote

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Customer Review

Based on 1 publication(s) in Google Scholar

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•Related Screening Libraries:

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View All Isoforms

MMP-1 MMP-2 MMP-3 MMP-8 MMP-9 MMP-13 MMP-14 MMP-17 ADAM10 ADAM17 MMP-7 MMP-12 MMP-10 MMP ADAM8

Biological Activity
Purity & Documentation
References
Customer Review

Description

BI-4394 (MMP13-IN-3) is a potent, selective, and orally active MMP-13 inhibitor (IC₅₀=1 nM^[1]) for the potential treatment of osteoarthritis^[2]. BI-4394 is >1000 selective over other MMPs^[1].

IC₅₀ & Target^[1]

MMP-13

1 nM (IC₅₀)

MMP-14

8.3 μM (IC₅₀)

MMP-9

8.9 μM (IC₅₀)

MMP-10

16 μM (IC₅₀)

MMP-2

18 μM (IC₅₀)

In Vitro

BI-4394 (Compound 15) is potent in a full-length MMP-13 collagen degradation assay (11 nM) and is able to inhibit degradation of bovine nasal cartilage with an IC₅₀ of 31 nM. BI-4394 inhibits MMP-2, MMP-9, MMP-10 and MMP-14 with IC₅₀s of 18, 8.9, 16 and 8.3 μM, respectively^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

When dosed orally at 10 mg/kg or i.v. 1 mg/kg, BI-4394 (Compound 15) reaches micromolar plasma levels (AUC=1109±64 nM h/mL), displays modest clearance (CL=34 mL/min/kg), and shows acceptable bioavailability (39%). The V_ss is quite low at 0.26 mL/mi/kg rat pharmacokinetic profile. BI-4394 has short terminal elimination half-life (t_1/2=0.47 h for rat (1 mg/kg, i.v.) and rat (10 mg/kg, orally), respectively)^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

Animal Model:	Srapgue Dally Rats^[1]
Dosage:	10 mg/kg (oral gavage); 1 mg/kg (i.v.)
Administration:	Dosed orally (10 mg/kg); i.v. (1 mg/kg)(Pharmacokinetic Analysis)
Result:	T_1/2=0.47 h for rat (1 mg/kg, i.v.) and rat (10 mg/kg, orally) , respectively.

Molecular Weight

446.46

Formula

C₂₄H₂₂N₄O₅

CAS No.

1222173-37-6

Appearance

Solid

Color

White to off-white

SMILES

O=C(C(N1)=CC2=C1C=CC(C3=CC(C(NCC4=CC=C(C(O)=O)C=C4)=O)=NN3C)=C2)OCC

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

Powder	-20°C	3 years
	4°C	2 years
In solvent	-80°C	6 months
	-20°C	1 month

Solvent & Solubility

In Vitro:

DMSO : 100 mg/mL (223.98 mM; ultrasonic and warming and heat to 60°C; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	2.2398 mL	11.1992 mL	22.3984 mL
5 mM	0.4480 mL	2.2398 mL	4.4797 mL
10 mM	0.2240 mL	1.1199 mL	2.2398 mL

View the Complete Stock Solution Preparation Table

* Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

Molarity Calculator
Dilution Calculator

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

Dosage

mg/kg

Animal weight
(per animal)

Dosing volume
(per animal)

μL

Number of animals

Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Calculation results:

Working solution concentration: mg/mL

Purity & Documentation

Purity: 99.91%

Select Batch:

Data Sheet (274 KB) SDS (251 KB)

COA (248 KB) HNMR (289 KB) LCMS (266 KB)

Handling Instructions (2659 KB)

References

[1]. Taylor SJ, et al. Fragment-based discovery of indole inhibitors of matrix metalloproteinase-13. J Med Chem. 2011 Dec 8;54(23):8174-87. [Content Brief]

[2]. Ruminski PG, et al. Discovery of N-(4-Fluoro-3-methoxybenzyl)-6-(2-(((2S,5R)-5-(hydroxymethyl)-1,4-dioxan-2-yl)methyl)-2H-tetrazol-5-yl)-2-methylpyrimidine-4-carboxamide. A Highly Selective and Orally Bioavailable Matrix Metalloproteinase-13 Inhibitor for the Potential Treatment of Osteoarthritis. J Med Chem. 2016 Jan 14;59(1):313-27. [Content Brief]

Complete Stock Solution Preparation Table

Optional Solvent	Concentration Solvent Mass	1 mg	5 mg	10 mg	25 mg

DMSO	1 mM	2.2398 mL	11.1992 mL	22.3984 mL	55.9961 mL
	5 mM	0.4480 mL	2.2398 mL	4.4797 mL	11.1992 mL
	10 mM	0.2240 mL	1.1199 mL	2.2398 mL	5.5996 mL
	15 mM	0.1493 mL	0.7466 mL	1.4932 mL	3.7331 mL
	20 mM	0.1120 mL	0.5600 mL	1.1199 mL	2.7998 mL
	25 mM	0.0896 mL	0.4480 mL	0.8959 mL	2.2398 mL
	30 mM	0.0747 mL	0.3733 mL	0.7466 mL	1.8665 mL
	40 mM	0.0560 mL	0.2800 mL	0.5600 mL	1.3999 mL
	50 mM	0.0448 mL	0.2240 mL	0.4480 mL	1.1199 mL
	60 mM	0.0373 mL	0.1867 mL	0.3733 mL	0.9333 mL
	80 mM	0.0280 mL	0.1400 mL	0.2800 mL	0.7000 mL
	100 mM	0.0224 mL	0.1120 mL	0.2240 mL	0.5600 mL

BI-4394 Related Classifications

Inflammation/Immunology

Help & FAQs

Do most proteins show cross-species activity?
Species cross-reactivity must be investigated individually for each product. Many human cytokines will produce a nice response in mouse cell lines, and many mouse proteins will show activity on human cells. Other proteins may have a lower specific activity when used in the opposite species.

Keywords:

BI-43941222173-37-6MMP13-IN-3BI4394BI 4394MMPMatrix metalloproteinasesMMP-13osteoarthritisInhibitorinhibitorinhibit

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BI-4394 (Synonyms: MMP13-IN-3)

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Biological Activity

Purity & Documentation

References

Customer Review

BI-4394 Related Antibodies

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Dilution Calculator

Complete Stock Solution Preparation Table

BI-4394 Related Classifications

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