Riboflavin

Riboflavin

SCHEMBL246757

Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C.Cl.[NaH]

nearest known ligand 0.96

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 Riboflavin. 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
ESR1 known ✓ P03372 1/20 0.71
NR3C1 known ✓ P04150 1/20 0.71
ADRB2 known ✓ P07550 1/20 0.71
HTR2C known ✓ P28335 1/20 0.71
ADRA1A known ✓ P35348 1/20 0.71
PTGS2 known ✓ P35354 1/20 0.71
AGTR1 known ✓ P30556 1/20 0.71
NTRK1 known ✓ P04629 1/20 0.43
GAA known ✓ P10253 1/20 0.33
MEN1 O00255 7/20 0.96
KMT2A Q03164 7/20 0.96
USP2 O75604 4/20 0.96
KDM4E B2RXH2 4/20 0.96
HAT1 O14929 4/20 0.96
RBBP7 Q16576 4/20 0.96
HTT P42858 4/20 0.96
RECQL P46063 3/20 0.96
CASP7 P55210 3/20 0.96
MAPT P10636 3/20 0.96
CASP1 P29466 2/20 0.96

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
Riboflavin SCHEMBL1064647 1.00 MEN1 (0.96) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL4380877 0.99 MEN1 (0.98) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL5084898 0.99 MEN1 (0.98) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL1983532 0.99 MEN1 (0.98) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL5084919 0.99 MEN1 (0.98) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL15513459 0.98 MEN1 (0.96) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL6364649 0.98 MEN1 (0.96) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL28003822 0.98 MEN1 (0.96) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL7707 0.98 MEN1 (1.00) MEN1KMT2AUSP2KDM4EHAT1
Riboflavin SCHEMBL12979917 0.98 MEN1 (1.00) MEN1KMT2AUSP2KDM4EHAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024090652-A1 WATER-SOLUBLE MILK THISTLE AND METHOD FOR PREPARING SAME 주식회사 보고신약 2024-05-02 WO disclosed
WO-2023191515-A1 COMPOSITION FOR PREVENTING HAIR LOSS OR PROMOTING HAIR GROWTH COMPRISING INDIRUBIN DERIVATIVE AND METABOLIC ACTIVATOR 연세대학교 산학협력단 2023-10-05 WO disclosed
US-11773081-B2 Pharmaceutical composition for preventing or treating wound, comprising indirubin derivative as active ingredient CK REGEON INC. (KR) 2023-10-03 US disclosed
US-20230257434-A1 CELL-DERIVED VESICLES COMPRISING TARGET PROTEIN AND METHOD FOR PRODUCING SAME SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2023-08-17 US disclosed
WO-2023106777-A1 VITAL MELON (KCTC14699BP) AND ANTI-OBESITY COMPOSITION COMPRISING EXTRACT THEREOF 광동제약 주식회사 2023-06-15 WO disclosed
EP-3662891-B1 COMPOSITION FOR PREVENTING HAIR LOSS OR PROMOTING HAIR GROWTH CK REGEON INC (KR) 2023-06-07 EP disclosed
CN-111093620-B Composition for preventing hair loss or promoting hair growth CK雷容股份有限公司 2023-05-05 CN disclosed
US-20230105449-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING WOUND, COMPRISING INDIRUBIN DERIVATIVE AS ACTIVE INGREDIENT CK BIOTECH (KR) 2023-04-06 US disclosed
EP-4026550-A1 COMPOSITION FOR PREVENTING OR TREATING SALIVARY GLAND DISESAES USING CELL-DERIVED VESICLE MDimune Inc. (KR) 2022-07-13 EP disclosed
CN-114599380-A Composition for preventing or treating salivary gland diseases using cell-derived vesicle 美德邈医药公司 2022-06-07 CN disclosed
WO-2005120534-A1 PONCIRUS TRIFOLIATA EXTRACT FOR PREVENTING AND TREATING ISCHEMIC HEART DISEASES AND PHAR¬ MACEUTICAL COMPOSITION AND HEALTH FOOD CONTAINING THE SAME PURIMED CO., LTD. (KR) 2005-12-22 WO disclosed
WO-2005120533-A1 POLYGALA TENUIFOLIA EXTRACT FOR PREVENTING AND TREATING ISCHEMIC HEART DISEASE AND PHAR¬ MACEUTICAL COMPOSITION AND HEALTH FOOD CONTAINING THE SAME PURIMED CO., LTD. (KR) 2005-12-22 WO disclosed
WO-2005120532-A1 NELUMBINIS SEMEN EXTRACT FOR PREVENTING AND TREATING ISCHEMIC HEART DISEASE AND PHARMACEUTICAL COMPOSITION AND HEALTH FOOD CONTAINING THE SAME PURIMED CO., LTD. (KR) 2005-12-22 WO disclosed
WO-2005112912-A1 IMMUNOMODUATING AGENT, ANTI-CANCER AGENT AND HEALTH FOOD CONTAINING MONOACETYLDIACYLGLYCEROL DERIVATIVES KIM SANG-HEE (KR) 2005-12-01 WO disclosed
WO-2005074963-A1 COMPOSITION FOR PREVENTION AND TREATMENT OF DIABETIC COMPLICATION KOREA INSTITUTE OF ORIENTAL MEDICINE (KR) 2005-08-18 WO disclosed
WO-2005067404-A2 HEALTH FOOD CONTAINING DISTILLED PINE-NEEDLE EXTRACT BAE GWANG SEOK (KR) 2005-07-28 WO disclosed
WO-2005063232-A1 OBESITY AND METABOLIC SYNDROME TREATMENT WITH TANSHINONE DERIVATIVES WHICH INCREASE METABOLIC ACTIVITY MD BIOALPHA CO., LTD. (KR) 2005-07-14 WO disclosed
WO-2005025588-A1 EXTRACT OF OGALPI, ERECTILE DYSFUNCTION FANNING HEALTHY FOOD AND ERECTILE DYSFUNCTION TREATING AGENT CONTAINING THE SAME KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2005-03-24 WO disclosed
WO-2005021021-A1 EXTRACT OF NELUMBINIS SEMEN FOR THE TREATMENT OF DEPRESSION PURIMED CO., LTD. (KR) 2005-03-10 WO disclosed
WO-2003092710-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING AN EXTRACT OF PELVETIA SILIQUOSA FOR THE PREVENTION OR THE TREATMENT OF LIVER DISEASE, DIABETES AND DIABETIC COMPLICATIONS SHIN KUK HYUN (KR) 2003-11-13 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 (2 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-11773081-B2 Pharmaceutical composition for preventing or treating wound, comprising indirubin derivative as active ingredient HES1, SHMT1, KDM5C ESR1 3363/4885NR3C1 3686/4885ADRB2 4498/4885
US-20230105449-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING WOUND, COMPRISING INDIRUBIN DERIVATIVE AS ACTIVE INGREDIENT HES1, SHMT1, KDM5C ESR1 3363/4885NR3C1 3686/4885ADRB2 4498/4885

“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.