Dactinomycin

Dactinomycin

SCHEMBL867979

CNNCc1ccc(C(=O)NC(C)C)cc1.Cc1c2oc3c(C)ccc(C(=O)N[C@@H]4C(=O)N[C@H](C(C)C)C(=O)N5CCC[C@H]5C(=O)N(C)CC(=O)N(C)[C@@H](C(C)C)C(=O)O[C@@H]4C)c3nc-2c(C(=O)N[C@@H]2C(=O)N[C@H](C(C)C)C(=O)N3CCC[C@H]3C(=O)N(C)CC(=O)N(C)[C@@H](C(C)C)C(=O)O[C@@H]2C)c(N)c1=O.Cl

nearest known ligand 0.83

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

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.83
GRB2 P62993 3/20 0.83
MAPT P10636 2/20 0.83
RECQL P46063 2/20 0.83
SMN1; SMN2 Q16637 2/20 0.83
ABCB11 O95342 1/20 0.83
ALDH1A1 P00352 1/20 0.83
CYP3A4 P08684 1/20 0.83
ALOX15 P16050 1/20 0.83
CASP1 P29466 1/20 0.83
HTT P42858 1/20 0.83
BLM P54132 1/20 0.83
CASP7 P55210 1/20 0.83
KMT2A Q03164 1/20 0.83
HIF1A Q16665 1/20 0.83
DDR2 Q16832 1/20 0.83
NGLY1 Q96IV0 1/20 0.83
HSD17B10 Q99714 1/20 0.83

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
Dactinomycin SCHEMBL2777524 0.99 GRB2 (0.84) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL20771248 0.94 GRB2 (0.74) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL2790145 0.92 GRB2 (0.99) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL3844 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL13659669 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL19770615 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL27304406 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL3845 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL6939686 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11
Dactinomycin SCHEMBL6152 0.91 GRB2 (1.00) GRB2MAPTRECQLSMN1; SMN2ABCB11

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 300 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012047664-A1 ANTI-PECAM THERAPY, COMPOSITIONS, METHODS, AND USES SUTTER WEST BAY HOSPITAL D/B/A CALIFORNIA PACIFIC MEDICAL CENTER (US) 2012-04-12 WO claimed
US-20120076795-A1 Anti-PECAM Therapy, Compositions, Methods, and Uses Sutter West Bay Hospitals D/B/A California Pacific Medical Center (US) 2012-03-29 US claimed
WO-2007092432-A2 LIQUID-FILLED NANODROPLETS FOR ANTI-CANCER THERAPY IMARX THERAPEUTICS, INC. (US) 2007-08-16 WO claimed
US-20070184076-A1 Liquid-filled nanodroplets for anti-cancer therapy IMA RY THERAPEUTICS, INC. 2007-08-09 US claimed
US-20030198664-A1 Lipid mediated screening of drug candidates for identification of active compounds FLORIDA, UNIVERSITY OF 2003-10-23 US claimed
WO-2003083443-A2 LIPID MEDIATED SCREENING OF DRUG CANDIDATES FOR IDENTIFICATION OF ACTIVE COMPOUNDS UNIVERSITY OF FLORIDA (US) 2003-10-09 WO claimed
US-5770222-A Therapeutic drug delivery systems IMARX PHARMACEUTICAL CORP. (US) 1998-06-23 US claimed
EP-3436049-B1 ANGIOPOIETIN-LIKE PROTEIN 8 (ANGPTL8) BAYLOR RES INSTITUTE (US) 2022-01-12 EP disclosed
US-11116788-B2 Compositions comprising sulfated polysaccharides and uses thereof ALGAMED THERAPEUTICS (A.M.T) LTD (IL) 2021-09-14 US disclosed
US-10947275-B2 Caged cell penetrating peptide-polymer conjugates for diagnostic and therapeutic applications BEN-GURION UNIVERSITY OF THE NEGEV RESEARCH AND DEVELOPMENT AUTHORITY (IL) 2021-03-16 US disclosed
US-20200368358-A1 DRUG-CONTAINING IMPLANTS AND METHODS OF USE THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-11-26 US disclosed
US-10736965-B2 Risperidone biodegradable implant THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-08-11 US disclosed
US-20200179520-A1 COMPOSITIONS AND METHODS FOR TARGETED TREATMENT AND IMAGING OF CANCER OR TUMORS WASHINGTON UNIVERSITY 2020-06-11 US disclosed
EP-0712293-A1 METHODS OF PREPARING GAS AND GASEOUS PRECURSOR-FILLED MICROSPHERES UNGER, Evan C (US) 1996-05-22 EP disclosed
EP-0711127-A1 METHODS OF PREPARING GAS-FILLED LIPOSOMES UNGER, Evan C (US) 1996-05-15 EP disclosed
EP-0707471-A1 NOVEL THERAPEUTIC DRUG DELIVERY SYSTEMS IMARX PHARMACEUTICAL CORP. (US) 1996-04-24 EP disclosed
US-5469854-A Methods of preparing gas-filled liposomes IMARX PHARMACEUTICAL CORP. (US) 1995-11-28 US disclosed
WO-1994028780-A2 METHODS OF PREPARING GAS AND GASEOUS PRECURSOR-FILLED MICROSPHERES UNGER EVAN C (US) 1994-12-22 WO disclosed
WO-1994028797-A1 METHODS OF PREPARING GAS-FILLED LIPOSOMES UNGER EVAN C (US) 1994-12-22 WO disclosed
WO-1994028873-A1 NOVEL THERAPEUTIC DRUG DELIVERY SYSTEMS UNGER EVAN C (US) 1994-12-22 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 (1 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-10947275-B2 Caged cell penetrating peptide-polymer conjugates for diagnostic and therapeutic applications LNPEP, PRCP, CLSPN PTGS1 4477/4885GRB2 3107/4885MAPT 2047/4885

“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.