Details of the Drug-Related molecule(s) Interaction Atlas

General Information of Drug (ID: DME3PUT)

• Drug Name: 4-(4-Benzyloxy-3-methoxy-benzylamino)-benzamidine Drug Info
• Synonyms: benzylamine 6; CHEMBL179938; BDBM13580

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Cross-matching ID:
  PubChem CID: 23646462
  TTD Drug ID: DME3PUT

Molecule-Related Drug Atlas

Drug(s) Targeting Cationic trypsinogen (PRSS1)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Bortezomib	DMNO38U	Leukemia		Approved	[2]
MELAGATRAN	DM4W8RE	N. A.	N. A.	Phase 3	[3]
Ulinastatin	DMIQCFG	Premature labour	JB00	Phase 3	[4]
Alpha-1 antitrypsin	DM5EFXZ	Coagulation defect	3B10.0	Phase 2	[5]
Dermolastin	DM6WSU2	Atopic dermatitis	EA80	Discontinued in Phase 2	[6]
RWJ-56423	DM6BIHE	Asthma	CA23	Discontinued in Phase 1	[7]
Patamostat	DM6HBQJ	Hypotension	BA20-BA21	Terminated	[5]
BMY-44621	DM8R3N0	N. A.	N. A.	Terminated	[8]
Grassystatin a	DM1PWX2	Discovery agent	N.A.	Investigative	[9]
2-(2-Hydroxy-phenyl)-1H-indole-5-carboxamidine	DM3UMYD	Discovery agent	N.A.	Investigative	[10]

Drug(s) Targeting Coagulation factor VII (F7)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Factor viia	DMZUW6P	Hemophilia	3B10.0	Approved	[11]
Vatreptacog alfa (activated)	DMANKTO	Bleeding disorder	GA20-GA21	Phase 3	[12]
BAX-817	DMB147A	Hemophilia	3B10.0	Phase 3	[13]
Activated recombinant FVII-albumin fusion protein	DMKY9GI	Hemophilia	3B10.0	Phase 2/3	[14]
Recombinant factor VIIa PEGylated liposomal	DMY3TAD	Factor VII deficiency	3B14	Phase 1/2	[11]
F-7TG	DML4JXZ	Hemophilia	3B10.0	Phase 1	[11]
Eptacog alfa	DMAQYRL	Hemophilia	3B10.0	Phase 1	[15]
CB-813	DMXQGKL	Hemophilia	3B10.0	Phase 1	[16]
BAY 86-6150	DM6R3WC	Hemophilia	3B10.0	Discontinued in Phase 2/3	[17]
RNAPc2	DME9V0I	Colorectal cancer	2B91.Z	Discontinued in Phase 2	[18]

Drug(s) Targeting Coagulation factor Xa (F10)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Apixaban	DM89JLN	Thrombosis	DB61-GB90	Approved	[19]
Rivaroxaban	DMQMBZ1	Deep vein thrombosis	BD71	Approved	[20]
DU-176b	DMCIJBH	Atrial fibrillation	BC81.3	Approved	[21]
Emicizumab	DM0AQ83	Factor VIII deficiency	3B10	Approved	[22]
BETRIXABAN	DM2C4RF	Venous thromboembolism	BD72	Approved	[23]
Lmw heparin	DMJPD06	Coagulation defect	3B10.0	Approved	[24]
Nadroparin calcium	DMBNKST	Coagulation defect	3B10.0	Approved	[25]
Fondaparinux sodium	DMWS3FH	Deep vein thrombosis	BD71	Approved	[26]
Danaparoid	DM6CLBN	Deep venous clot	BD71	Approved	[27]
Coagulation Factor IX	DM8HBJI	Haemophilia B	3B11.0	Approved	[28]

Drug(s) Targeting Coagulation factor IIa (F2)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Argatroban	DMFI46A	Thrombosis	DB61-GB90	Approved	[29]
Pyridoxal Phosphate	DMO2K0J	Malnutrition	5B50-5B71	Approved	[30]
Bivalirudin	DMECRX1	Thrombocytopenia	3B64	Approved	[31]
Ximelegatran	DMU8ANS	Myocardial infarction	BA41-BA43	Approved	[32]
Dabigatran	DMDI6R4	Stroke	8B20	Approved	[33]
Desirudin Recombinant	DM2BTFN	Coagulation defect	3B10.0	Approved	[34]
Human prothrombin complex concentrate	DMPHVQ1	Bleeding disorder	GA20-GA21	Approved	[35]
Lepirudin	DM1I3D5	Thrombocytopenia	3B64	Approved	[36]
Anisindione	DM2C48U	Coagulation defect	3B10.0	Approved	[37]
ATryn antithrombin	DM79Y2T	Multiple sclerosis	8A40	Approved	[38]

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Cationic trypsinogen (PRSS1)	TT2WR1T	TRY1_HUMAN	Inhibitor	[1]
Coagulation factor IIa (F2)	TT6L509	THRB_HUMAN	Inhibitor	[1]
Coagulation factor VII (F7)	TTF0EGX	FA7_HUMAN	Inhibitor	[1]
Coagulation factor Xa (F10)	TTCIHJA	FA10_HUMAN	Inhibitor	[1]

References

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• [2] Characterization of a class of peptide boronates with neutral P1 side chains as highly selective inhibitors of thrombin. J Med Chem. 1995 Apr 28;38(9):1511-22.
• [3] Orally active thrombin inhibitors. Part 1: optimization of the P1-moiety. Bioorg Med Chem Lett. 2006 May 15;16(10):2641-7.
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