Vincamine

Vincamine

SCHEMBL8134417

CC[C@]12CCCN3CCc4c(n(c5ccccc45)[C@@](O)(C(=O)OC)C1)[C@@H]32.Cl

nearest known ligand 0.98

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 Vincamine. 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 3/20 0.98
GAA known ✓ P10253 1/20 0.98
PDE4D known ✓ Q08499 2/20 0.77
HRH3 known ✓ Q9Y5N1 2/20 0.77
OPRK1 known ✓ P41145 1/20 0.77
CHRM2 known ✓ P08172 1/20 0.50
ADRA2A known ✓ P08913 1/20 0.50
ADRA2B known ✓ P18089 1/20 0.50
ADRA2C known ✓ P18825 1/20 0.50
SLC6A4 known ✓ P31645 1/20 0.50
DRD3 known ✓ P35462 1/20 0.50
HTR2B known ✓ P41595 1/20 0.50
SLC6A3 known ✓ Q01959 1/20 0.50
CYP3A4 P08684 6/20 0.98
CYP2D6 P10635 3/20 0.98
HIF1A Q16665 3/20 0.98
MEN1 O00255 3/20 0.98
KMT2A Q03164 3/20 0.98
KDM4E B2RXH2 2/20 0.98
MAPT P10636 2/20 0.98

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
Vincamine SCHEMBL30892136 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL3767 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL29710919 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL147179 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL8970683 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL14095103 0.99 CYP3A4 (1.00) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL6631357 0.97 CYP3A4 (0.96) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL5712113 0.97 CYP3A4 (0.96) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL6162410 0.96 CYP3A4 (0.95) CYP3A4KCNH2CYP2D6HIF1AMEN1
Vincamine SCHEMBL11619815 0.96 CYP3A4 (0.93) CYP3A4KCNH2CYP2D6HIF1AMEN1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4369175-A Process for the manufacture of prolonged action vincamine preparations, the vincamine preparations so obtained, and medicaments containing them CIBA-GEIGY CORPORATION (US) 1983-01-18 US claimed
CN-113754768-B Antibodies that bind CD39 and uses thereof 表面肿瘤学公司 2023-01-06 CN disclosed
CN-113444086-A Ezh2 inhibitor and application thereof 达纳-法伯癌症研究所股份有限公司 2021-09-28 CN disclosed
CN-113164477-A Pyrazolopyridine inhibitors of C-JUN-N-terminal kinase and uses thereof 达纳-法伯癌症研究所股份有限公司 2021-07-23 CN disclosed
CN-106029696-B anti-CD 3 antibodies and methods of use 基因泰克公司 2020-07-28 CN disclosed
EP-0573260-B1 New alkaloid derivatives, their use and pharmaceutical formulations containing them INDENA SPA (IT) 2000-05-10 EP disclosed
US-4431641-A AN ANTICONVULSANT DIBENZ/B,F/AZEPINE POTENTIATED BY A VINCAMINE OR PIRACETAM DERIVATIVE CIBA-GEIGY CORPORATION (US) 1984-02-14 US disclosed
US-4369175-A Process for the manufacture of prolonged action vincamine preparations, the vincamine preparations so obtained, and medicaments containing them CIBA-GEIGY CORPORATION (US) 1983-01-18 US disclosed
US-4199585-A ADMINISTERING VINCAMINE INSTITUTO CHEMIOTERAPICO DI LODI SPA, A CORP OF ITALY (IT) 1980-04-22 US disclosed
US-4178695-A BY FREEZE DRYING WITH CONTROLLED COOLING UNDER AGITATION TO PRODUCE MICROCRYSTALS ERBEIA ANGELO (FR) 1979-12-18 US disclosed
US-4140777-A Cerebral vasodilating 6-substituted vincamines ENRICO CORVI MORA (IT) 1979-02-20 US disclosed
US-4122179-A VASODILATORS Mora, Enrico Corvi (IT) 1978-10-24 US disclosed
US-3982002-A VASODILATOR, BRAIN OXYGENATOR ESPECIALIDADES LATINAS MEDICAMENTOS UNIVERSALES S.A. (ES) 1976-09-21 US disclosed