Gacyclidine

Gacyclidine

SCHEMBL1662223

C[C@H]1CCCC[C@@]1(c1cccs1)N1CCCCC1.Cl

nearest known ligand 0.56

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 Gacyclidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 known ✓ Q99720 4/20 0.56
SLC6A3 known ✓ Q01959 1/20 0.41
SLC6A2 known ✓ P23975 1/20 0.40
SLC6A4 known ✓ P31645 1/20 0.40
CHRM3 known ✓ P20309 2/20 0.39
OPRM1 known ✓ P35372 1/20 0.38
CHRM2 known ✓ P08172 1/20 0.37
CHRM4 known ✓ P08173 1/20 0.37
CHRM5 known ✓ P08912 1/20 0.37
CHRM1 known ✓ P11229 1/20 0.37
PRCP P42785 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
OPRL1 P41146 1/20 0.38
SLC6A9 P48067 2/20 0.37

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
Gacyclidine SCHEMBL5398234 1.00 SIGMAR1 (0.56) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL397836 0.99 SIGMAR1 (0.57) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL7190367 0.99 SIGMAR1 (0.57) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL3457748 0.99 SIGMAR1 (0.57) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL4465879 0.99 SIGMAR1 (0.57) SIGMAR1PRCPMEN1KMT2ASLC6A3
Hydrochloric Acid SCHEMBL8205944 0.83 MEN1 (0.41) SIGMAR1PRCPMEN1KMT2ASLC6A3
SCHEMBL8206550 0.82 MEN1 (0.42) SIGMAR1PRCPMEN1KMT2ASLC6A3
SCHEMBL7700857 0.80 PRCP (0.51) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL5402379 0.78 CYP1A2 (0.45) SIGMAR1PRCPMEN1KMT2ASLC6A3
Gacyclidine SCHEMBL14053284 0.77 GRIN1 (0.56) SIGMAR1PRCPMEN1KMT2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11918653-B2 Triglyceride otic formulations and uses thereof DOMPÉ FARMACEUTICI S.P.A. (IT) 2024-03-05 US disclosed
US-20210138069-A1 TRIGLYCERIDE OTIC FORMULATIONS AND USES THEREOF DOMPÉ FARMACEUTICI S.P.A. (IT) 2021-05-13 US disclosed
EP-2932971-A1 KETAMINE FORMULATIONS Otonomy, Inc. (US) 2015-10-21 EP disclosed
US-8771746-B2 Colloidal suspensions comprising a therapeutic agent and squalene OTONOMY, INC. (US) 2014-07-08 US disclosed
US-20120208848-A1 GACYCLIDINE FORMULATIONS NEUROSYSTEC CORPORATION (US) 2012-08-16 US disclosed
US-20120208851-A1 FORMULATIONS NEUROSYSTEC CORPORATION (US) 2012-08-16 US disclosed
US-20110136870-A1 GACYCLIDINE FORMULATIONS NEUROSYSTEC CORPORATION (US) 2011-06-09 US disclosed
EP-2306839-A1 GACYCLIDINE FORMULATIONS Neurosystec Corporation (US) 2011-04-13 EP disclosed
EP-2307021-A1 FORMULATIONS Neurosystec Corporation (US) 2011-04-13 EP disclosed
WO-2009155421-A1 GACYCLIDINE FORMULATIONS NEUROSYSTEC CORPORATION (US) 2009-12-23 WO disclosed
WO-2009155401-A1 FORMULATIONS NEUROSYSTEC CORPORATION (US) 2009-12-23 WO disclosed
EP-2056793-A2 FREE BASE GACYCLIDINE NANOPARTICLES Neurosystec Corporation (US) 2009-05-13 EP disclosed
EP-2046437-A2 DEVICES, SYSTEMS AND METHODS FOR OPHTHALMIC DRUG DELIVERY Neurosystec Corporation (US) 2009-04-15 EP disclosed
US-20080152694-A1 Devices, Systems and Methods for Ophthalmic Drug Delivery NEUROSYSTEC CORPORATION (US) 2008-06-26 US disclosed
US-20080145439-A1 NANOPARTICLE DRUG FORMULATIONS NEUROSYSTEC CORPORATION (US) 2008-06-19 US disclosed
WO-2008016602-A2 FREE BASE GACYCLIDINE NANOPARTICLES NEUROSYSTEC CORPORATION (US) 2008-02-07 WO disclosed
WO-2008011125-A2 DEVICES, SYSTEMS AND METHODS FOR OPHTHALMIC DRUG DELIVERY NEUROSYSTEC CORPORATION (US) 2008-01-24 WO disclosed
EP-1861104-A2 IMPROVED GACYCLIDINE FORMULATIONS Neurosystec Corporation (US) 2007-12-05 EP disclosed
US-20060205789-A1 Gacyclidine formulations NEUROSYSTEC CORPORATION (US) 2006-09-14 US disclosed
WO-2006096518-A2 IMPROVED GACYCLIDINE FORMULATIONS NEUROSYSTEC CORPORATION (US) 2006-09-14 WO 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 (5 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-20210138069-A1 TRIGLYCERIDE OTIC FORMULATIONS AND USES THEREOF CETP, LIPA, APOB SIGMAR1 3104/4885SLC6A3 2323/4885SLC6A2 1859/4885
US-20110136870-A1 GACYCLIDINE FORMULATIONS DCTD, TYMP, TYMS SIGMAR1 4210/4885SLC6A3 1046/4885SLC6A2 1054/4885
US-20120208848-A1 GACYCLIDINE FORMULATIONS DCTD, TYMP, TYMS SIGMAR1 4210/4885SLC6A3 1046/4885SLC6A2 1054/4885
US-11918653-B2 Triglyceride otic formulations and uses thereof CETP, LIPA, APOB SIGMAR1 3104/4885SLC6A3 2323/4885SLC6A2 1859/4885
US-20060205789-A1 Gacyclidine formulations DCTD, TYMP, TYMS SIGMAR1 4210/4885SLC6A3 1046/4885SLC6A2 1054/4885

“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.