Vamicamide

Vamicamide

SCHEMBL4603765

C[C@H](C[C@@](C(N)=O)(c1ccccc1)c1ccccn1)N(C)C.Cl

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Vamicamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 known ✓ Q12809 4/20 0.64
▸ OPRK1 known ✓ P41145 2/20 0.64
▸ ADRB3 known ✓ P13945 1/20 0.64
▸ PDE3A known ✓ Q14432 1/20 0.64
▸ GRIN1 known ✓ Q05586 6/20 0.59
▸ GRIN2A known ✓ Q12879 6/20 0.59
▸ GRIN2D known ✓ O15399 5/20 0.59
▸ GRIN2C known ✓ Q14957 5/20 0.59
▸ GRIN2B known ✓ Q13224 4/20 0.59
▸ OPRM1 known ✓ P35372 3/20 0.59
▸ DRD3 known ✓ P35462 2/20 0.59
▸ CACNA1F known ✓ O60840 1/20 0.59
▸ DRD4 known ✓ P21917 1/20 0.59
▸ OPRD1 known ✓ P41143 1/20 0.59
▸ CACNA1D known ✓ Q01668 1/20 0.59
▸ CACNA1S known ✓ Q13698 1/20 0.59
▸ CACNA1C known ✓ Q13936 1/20 0.59
▸ CHRM2 known ✓ P08172 2/20 0.42
▸ CHRM3 known ✓ P20309 2/20 0.42
▸ CHRM1 known ✓ P11229 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Vamicamide SCHEMBL9393357 1.00 KCNH2 (0.64) KCNH2OPRK1BLMSLC22A2SLC22A1
Vamicamide SCHEMBL30700593 0.99 KCNH2 (0.65) KCNH2OPRK1BLMSLC22A2SLC22A1
Vamicamide SCHEMBL9393264 0.99 KCNH2 (0.65) KCNH2OPRK1BLMSLC22A2SLC22A1
Vamicamide SCHEMBL331820 0.99 KCNH2 (0.65) KCNH2OPRK1BLMSLC22A2SLC22A1
Aminopentamide Sulfate SCHEMBL251458 0.84 GRIN1 (0.75) KCNH2OPRK1BLMSLC22A2SLC22A1
Disopyramide SCHEMBL546251 0.80 KCNH2 (0.98) KCNH2OPRK1BLMSLC22A2SLC22A1
Aminopentamide Sulfate SCHEMBL203612 0.79 GRIN1 (0.68) KCNH2OPRK1BLMSLC22A2SLC22A1
Disopyramide SCHEMBL23931452 0.78 KCNH2 (1.00) KCNH2OPRK1BLMSLC22A2SLC22A1
Disopyramide SCHEMBL16153 0.78 KCNH2 (1.00) KCNH2OPRK1BLMSLC22A2SLC22A1
(S)-Disopyramide SCHEMBL41811 0.78 KCNH2 (1.00) KCNH2OPRK1BLMSLC22A2SLC22A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1915992-A1 USE OF CYCLOOXYGENASE INHIBITORS AND ANTIMUSCARINIC AGENTS FOR THE TREATMENT OF INCONTINENCE Pharmacia Corporation (US) 2008-04-30 — — EP claimed
WO-2007072503-A2 COMBINATIONS FOR MANAGING INFLAMMATION AND ASSOCIATED DISORDERS PANACEA BIOTEC LTD. (IN) 2007-06-28 — — WO claimed
US-20050261328-A1 Pharmaceutical composition comprising beta-3-adrenoceptor-agonists and antimuscarinic agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 — — US claimed
CN-1633283-A Use of cyclooxygenase inhibitors and antimuscarinic agents for the treatment of incontinence PHARMACIA CORP (US) 2005-06-29 — — CN claimed
EP-1476146-A1 USE OF CYCLOOXYGENASE INHIBITORS AND ANTIMUSCARINIC AGENTS FOR THE TREATMENT OF INCONTINENCE Pharmacia Corporation (US) 2004-11-17 — — EP claimed
US-20030191172-A1 Method of using cyclooxygenase inhibitors and antimuscarinic agents VERSI EBRAHIM (US) 2003-10-09 — — US claimed
WO-2003070233-A1 USE OF CYCLOOXYGENASE INHIBITORS AND ANTIMUSCARINIC AGENTS FOR THE TREATMENT OF INCONTINENCE PHARMACIA CORPORATION (US) 2003-08-28 — — WO claimed
EP-1915992-A1 USE OF CYCLOOXYGENASE INHIBITORS AND ANTIMUSCARINIC AGENTS FOR THE TREATMENT OF INCONTINENCE Pharmacia Corporation (US) 2008-04-30 — — EP disclosed
WO-2007072503-A2 COMBINATIONS FOR MANAGING INFLAMMATION AND ASSOCIATED DISORDERS PANACEA BIOTEC LTD. (IN) 2007-06-28 — — WO disclosed
US-20070078181-A1 Use of a beta-3-agonist for the treatment of patients with spinal cord injury and suffering from renal and bladder complaints MICHEL MARTIN C 2007-04-05 — — US disclosed
US-20060084700-A1 Use of a beta-3 agonist for the treatment of disorders of the prostate and of the lower urogenital tract BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-04-20 — — US disclosed
US-20050261328-A1 Pharmaceutical composition comprising beta-3-adrenoceptor-agonists and antimuscarinic agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 — — US disclosed
CN-1633283-A Use of cyclooxygenase inhibitors and antimuscarinic agents for the treatment of incontinence PHARMACIA CORP (US) 2005-06-29 — — CN disclosed
EP-0452809-B1 A therapeutic agent for pollakiuria, urinary urgency or incontinence of urine comprising alpha-phenyl-alpha-pyridylalkanoic acid derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1994-07-27 — — EP disclosed
EP-0452809-A2 A therapeutic agent for pollakiuria, urinary urgency or incontinence of urine comprising alpha-phenyl-alpha-pyridylalkanoic acid derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-10-23 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050261328-A1 Pharmaceutical composition comprising beta-3-adrenoceptor-agonists and antimuscarinic agents ADRB3, ADRB2, ADRB1 KCNH2 816/4885OPRK1 44/4885ADRB3 1/4885
US-20060084700-A1 Use of a beta-3 agonist for the treatment of disorders of the prostate and of the lower urogenital tract ADRB3, ADRB2, ADRB1 KCNH2 2041/4885OPRK1 65/4885ADRB3 1/4885
US-20070078181-A1 Use of a beta-3-agonist for the treatment of patients with spinal cord injury and suffering from renal and bladder complaints ADRB3, ADRB2, ADRB1 KCNH2 466/4885OPRK1 16/4885ADRB3 1/4885
US-20030191172-A1 Method of using cyclooxygenase inhibitors and antimuscarinic agents PTGS2, PTGES2, PTGS1 KCNH2 2454/4885OPRK1 123/4885ADRB3 140/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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