Known targets — ChEMBL curated mechanism
ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Pivalate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Pivalate SCHEMBL3266696 | 1.00 | — | — | |
| Pivalate SCHEMBL5274713 | 1.00 | TSHR (0.57) | — | |
| Pivalate SCHEMBL7263312 | 0.96 | TSHR (0.53) | — | |
| Pivalate SCHEMBL4318862 | 0.95 | — | — | |
| Pivalate SCHEMBL3613 | 0.95 | — | — | |
| Pivalate SCHEMBL332912 | 0.95 | TSHR (0.61) | — | |
| Pivalate SCHEMBL5116637 | 0.95 | TSHR (0.61) | — | |
| Pivalate SCHEMBL23001579 | 0.91 | — | — | |
| Pivalate SCHEMBL15771206 | 0.91 | — | — | |
| Pivalate SCHEMBL6511203 | 0.91 | — | — |
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 726 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106082466-B | A kind of large size multistage composite water purification control system and its process for purifying water | 徐州工程学院 | 2019-06-14 | — | — | CN | claimed |
| CN-108689834-A | A kind of preparation method of the chloro- 2,2- dimethylpropionic acid chlorides of 3- | 江苏联化科技有限公司 | 2018-10-23 | — | — | CN | claimed |
| CN-106749072-A | The preparation method of clomazone | 江苏长青生物科技有限公司 | 2017-05-31 | — | — | CN | claimed |
| CN-104744392-A | Efavirenz preparation method | CHU HAIYAN | 2015-07-01 | — | — | CN | claimed |
| CN-104277008-A | Process for the preparation of clomazone, novel forms thereof and uses thereof | ROTAM AGROCHEM INT CO LTD | 2015-01-14 | — | — | CN | claimed |
| US-8772544-B2 | Process for the production of bimatoprost | SANDOZ AG (CH) | 2014-07-08 | — | — | US | claimed |
| US-20110178340-A1 | IMPROVED PROCESS FOR THE PRODUCTION OF BIMATOPROST | SANDOZ AG (CH) | 2011-07-21 | — | — | US | claimed |
| EP-2321260-A2 | IMPROVED PROCESS FOR THE PRODUCTION OF BIMATOPROST | Sandoz AG (CH) | 2011-05-18 | — | — | EP | claimed |
| EP-2164832-A1 | PROCESS FOR PREPARING 2-(2-PYRIDYLMETHYL)-SULFINYL-1H-BENZIMIDAZOLES AND THE INTERMEDIATE COMPOUNDS USED THEREIN | Química Sintética, S.A. (ES) | 2010-03-24 | — | — | EP | claimed |
| EP-2135860-A1 | Improved process for the production of bimatoprost | Sandoz AG (CH) | 2009-12-23 | — | — | EP | claimed |
| WO-2009153206-A2 | Improved Process for the Production of Bimatoprost | SANDOZ AG (CH) | 2009-12-23 | — | — | WO | claimed |
| WO-2008142006-A9 | PROCESS FOR PREPARING 2-(2-PYRIDYLMETHYL)-SULFINYL-1H-BENZIMIDAZOLES AND THE INTERMEDIATE COMPOUNDS USED THEREIN | CHEMO IBÉRICA, S.A. (ES) | 2009-09-24 | — | — | WO | claimed |
| WO-2008142006-A1 | PROCESS FOR PREPARING 2-(2-PYRIDYLMETHYL)-SULFINYL-1H-BENZIMIDAZOLES AND THE INTERMEDIATE COMPOUNDS USED THEREIN | CHEMO IBÉRICA, S.A. (ES) | 2008-11-27 | — | — | WO | claimed |
| EP-1992619-A1 | Process for preparing 2-(2-pyridylmethyl)-sulfinyl-1H-benzimidazoles and the intermediate compounds used therein | Quimica Sintetica, S.A. (ES) | 2008-11-19 | — | — | EP | claimed |
| CN-1106383-C | Estrogenic agents | AMERICAN HOME PROD (US) | 2003-04-23 | — | — | CN | claimed |
| US-4272502-A | Process for preparing gaseous hydrogen chloride from dilute aqueous hydrochloric acid | CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) | 1981-06-09 | — | — | US | claimed |
| US-4088668-A | Acetylene derivatives | MERRELL TORAUDE ET COMPAGNIE (FR) | 1978-05-09 | — | — | US | claimed |
| JP-63262642-A | — | — | None | — | — | JP | disclosed |
| US-3932465-A | ANTIBIOTIC | CIBA-GEIGY CORPORATION (US) | 1976-01-13 | — | — | US | disclosed |
| US-3930793-A | CONTINUOUS, DISAZO DYES | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-01-06 | — | — | US | disclosed |