Hydroxyfasudil

Hydroxyfasudil

SCHEMBL1845381

Cl.O=S(=O)(c1cccc2c(O)nccc12)N1CCCNCC1

nearest known ligand 0.73

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 Hydroxyfasudil. 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
ROCK2 known ✓ O75116 6/20 0.73
ROCK1 known ✓ Q13464 5/20 0.73
PRKCE known ✓ Q02156 3/20 0.73
PRKCD known ✓ Q05655 3/20 0.73
PRKD1 known ✓ Q15139 3/20 0.73
KCNH2 known ✓ Q12809 2/20 0.61
PRKD3 known ✓ O94806 2/20 0.61
PRKCG known ✓ P05129 2/20 0.61
PRKCB known ✓ P05771 2/20 0.61
PRKCA known ✓ P17252 2/20 0.61
PRKCH known ✓ P24723 2/20 0.61
PRKCI known ✓ P41743 2/20 0.61
PRKCQ known ✓ Q04759 2/20 0.61
PRKCZ known ✓ Q05513 2/20 0.61
HTR1A known ✓ P08908 1/20 0.61
ADRA2A known ✓ P08913 1/20 0.61
ADRA2B known ✓ P18089 1/20 0.61
SLC6A4 known ✓ P31645 1/20 0.61
HRH1 known ✓ P35367 1/20 0.61
OPRK1 known ✓ P41145 1/20 0.61

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
Hydroxyfasudil SCHEMBL30198128 1.00 ROCK2 (0.73) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL31717522 0.99 ROCK2 (0.72) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL1827528 0.99 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL29473349 0.99 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL30309462 0.99 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL2907389 0.94 ROCK2 (0.67) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL9617966 0.86 SMN1; SMN2 (0.67) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL13513878 0.86 ROCK2 (0.77) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL6845278 0.85 ROCK2 (1.00) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL2908958 0.85 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110223177-A1 TREATMENT OF FIBROTIC EYE DISORDERS UNIVERSITY OF EAST ANGLIA (GB) 2011-09-15 US claimed
EP-2323637-A1 TREATMENT OF FIBROTIC EYE DISORDERS University of East Anglia (GB) 2011-05-25 EP claimed
WO-2010029350-A1 TREATMENT OF FIBROTIC EYE DISORDERS UNIVERSITY OF EAST ANGLIA (GB) 2010-03-18 WO claimed
US-20110223177-A1 TREATMENT OF FIBROTIC EYE DISORDERS UNIVERSITY OF EAST ANGLIA (GB) 2011-09-15 US disclosed
EP-1074545-A1 ISOQUINOLINESULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Hidaka, Hiroyoshi (JP) 2001-02-07 EP disclosed