Known targets — ChEMBL curated mechanism
ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Nitromethane. 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 | |
|---|---|---|---|---|
| Nitromethane SCHEMBL28102645 | 1.00 | — | — | |
| Nitromethane SCHEMBL28020774 | 0.95 | — | — | |
| Nitromethane SCHEMBL14686120 | 0.95 | — | — | |
| Nitromethane SCHEMBL14686122 | 0.95 | — | — | |
| Nitromethane SCHEMBL22685862 | 0.95 | — | — | |
| Nitromethane SCHEMBL27366359 | 0.94 | — | — | |
| Nitromethane SCHEMBL525 | 0.94 | — | — | |
| Nitromethane SCHEMBL29707679 | 0.94 | — | — | |
| Nitromethane SCHEMBL1890507 | 0.89 | — | — | |
| Nitromethane SCHEMBL8771927 | 0.89 | — | — |
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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112034008-A | Graphene crystal structure quality evaluation method | 电子科技大学 | 2020-12-04 | — | — | CN | claimed |
| CN-110627193-A | Biofilm reactor treatment device and method for chlorine disinfection byproducts | 杭州师范大学 | 2019-12-31 | — | — | CN | claimed |
| CN-107574230-A | The composition and method for the hybridization being individually denatured for carrying out sample and probe | 丹麦达科有限公司 | 2018-01-12 | — | — | CN | claimed |
| CN-102369295-A | Compositions and methods for performing hybridization with separate denaturation of sample and probe | DAKO DENMARK AS | 2012-03-07 | — | — | CN | claimed |
| CN-102084004-A | Hybridization compositions and methods | DAKO DENMARK AS | 2011-06-01 | — | — | CN | claimed |
| CN-102046808-A | Compositions and methods for detecting chromosomal aberrations using novel hybridization buffers | DAKO DENMARK AS | 2011-05-04 | — | — | CN | claimed |
| CN-117720559-A | Keggin type polyacid-based Cu (II) coordination ion crystal and preparation method thereof | 北京化工大学 | 2024-03-19 | — | — | CN | disclosed |
| CN-117069576-A | Method for synthesizing calcium formate by direct oxidation of methanol | 浙江工业大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-109641068-B | Method and device for preparing ultrasonic contrast agent | 蓝瑟斯医学影像公司 | 2022-09-30 | — | — | CN | disclosed |
| CN-112034008-A | Graphene crystal structure quality evaluation method | 电子科技大学 | 2020-12-04 | — | — | CN | disclosed |
| CN-107574230-A | The composition and method for the hybridization being individually denatured for carrying out sample and probe | 丹麦达科有限公司 | 2018-01-12 | — | — | CN | disclosed |
| CN-102369295-B | Compositions and methods for performing hybridization with separate denaturation of sample and probe | 丹麦达科有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-107254513-A | It is used for the composition and method for detecting chromosome aberration using new hybridization buffer | 丹麦达科有限公司 | 2017-10-17 | — | — | CN | disclosed |
| CN-102046808-A | Compositions and methods for detecting chromosomal aberrations using novel hybridization buffers | DAKO DENMARK AS | 2011-05-04 | — | — | CN | disclosed |
| US-20100204470-A1 | METHOD FOR SALT PREPARATION | SANDOZ AG | 2010-08-12 | — | — | US | disclosed |
| EP-2145890-A2 | Crystallization of hydrohalides of pharmaceutical compounds | Sandoz AG (CH) | 2010-01-20 | — | — | EP | disclosed |
| EP-2032521-B1 | NEW METHOD FOR SALT PREPARATION | SANDOZ AG (CH) | 2009-10-28 | — | — | EP | disclosed |
| EP-2032521-A2 | NEW METHOD FOR SALT PREPARATION | Sandoz AG (CH) | 2009-03-11 | — | — | EP | disclosed |
| WO-2008000418-A2 | NEW METHOD FOR SALT PREPARATION | SANDOZ AG (CH) | 2008-01-03 | — | — | WO | disclosed |
| US-5449582-A | Pigment-Lewis acid complex | XEROX CORPORATION (US) | 1995-09-12 | — | — | US | disclosed |