Y-27632

Y-27632

SCHEMBL1554110

CC(N)[C@H]1CC[C@H](C(=O)Nc2ccncc2)CC1.Cl.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 Y-27632. 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 8/20 1.00
ROCK1 known ✓ Q13464 8/20 1.00
PRKCE known ✓ Q02156 1/20 1.00
PRKD3 known ✓ O94806 2/20 0.97
PRKCQ known ✓ Q04759 2/20 0.97
PRKCD known ✓ Q05655 2/20 0.97
KCNH2 known ✓ Q12809 1/20 0.97
GLA known ✓ P06280 1/20 0.55
PRKCG known ✓ P05129 1/20 0.54
PRKCI known ✓ P41743 1/20 0.54
ACVR1 known ✓ Q04771 1/20 0.54
ALK known ✓ Q9UM73 1/20 0.54
PKN2 Q16513 4/20 1.00
TP53 P04637 2/20 1.00
CYP3A4 P08684 2/20 1.00
LMNA P02545 2/20 1.00
ALOX15 P16050 1/20 1.00
RPS6KA5 O75582 3/20 0.97
LRRK2 Q5S007 3/20 0.97
CDK1 P06493 2/20 0.97

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
Y-27632 SCHEMBL819701 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL819702 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL29129858 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL30686996 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL1165652 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL2834049 1.00 ROCK2 (1.00) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL364637 0.99 ROCK2 (0.97) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL21954489 0.99 ROCK2 (0.97) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL4296190 0.99 ROCK2 (0.97) ROCK2ROCK1PKN2TP53CYP3A4
Y-27632 SCHEMBL364638 0.99 ROCK2 (0.97) ROCK2ROCK1PKN2TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113811605-B Method for obtaining eye progenitor cells from human pluripotent stem cells 诺和诺德股份有限公司 2024-09-27 CN disclosed
CN-114729323-B Rotationally aggregated neural microsphere and application thereof 诺和诺德股份有限公司 2024-09-17 CN disclosed
CN-112567023-B Mature airway organoids, methods of making and uses thereof 香港大学 2024-06-11 CN disclosed
CN-118076727-A Alveolar organoids and methods of making and using the same 港大科桥有限公司 2024-05-24 CN disclosed
CN-114174497-B Generation of neural stem cell lines derived from human pluripotent stem cells 诺和诺德股份有限公司 2024-03-01 CN disclosed
WO-2023118101-A1 STACKED BMP INHIBITION FOR NEURAL INDUCTION OF PLURIPOTENT STEM CELLS NOVO NORDISK A/S (DK) 2023-06-29 WO disclosed
CN-108431209-B Derived and mature hepatocyte types of liver stem cells and uses thereof 新加坡科技研究局 2023-02-10 CN disclosed
EP-4061929-A1 SPIN-AGGREGATED NEURAL MICROSPHERES AND THE APPLICATION THEREOF Novo Nordisk A/S (DK) 2022-09-28 EP disclosed
US-20220233602-A1 GENERATION OF NEURAL STEM CELL LINES DERIVED FROM HUMAN PLURIPOTENT STEM CELLS NOVO NORDISK A/S (DK) 2022-07-28 US disclosed
CN-114729323-A Rotary aggregation nerve microsphere and application thereof 诺和诺德股份有限公司 2022-07-08 CN disclosed
EP-1459742-A2 Agent for prophylaxis and treatment of asthenopia and pseudomyopia Senju Pharmaceutical Co., Ltd. (JP) 2004-09-22 EP disclosed
EP-1459743-A2 Agent for prophylaxis and treatment of glaucoma Senju Pharmaceutical Co., Ltd. (JP) 2004-09-22 EP disclosed
US-6794398-B1 Preventive/remedies for liver diseases MITSUBISHI PHARMA CORPORATION (JP) 2004-09-21 US disclosed
US-6673812-B1 ADMINISTERING EFFECTIVE AMOUNT OF COMPOUND HAVING RHO KINASE INHIBITORY ACTIVITY SENJU PHARMACEUTICAL CO., LTD. (JP) 2004-01-06 US disclosed
US-6649625-B2 Agent for prophylaxis and treatment of glaucoma SENJU PHARMACEUTICAL CO., LTD. (JP) 2003-11-18 US disclosed
US-20030125351-A1 Agent for prophylaxis and treatment of glaucoma AZUMA MITSUYOSHI (JP) 2003-07-03 US disclosed
EP-1177796-A1 PREVENTIVES/REMEDIES FOR LIVER DISEASES Mitsubishi Pharma Corporation (JP) 2002-02-06 EP disclosed
EP-1174150-A1 PREVENTIVES/REMEDIES FOR ANGIOSTENOSIS Mitsubishi Pharma Corporation (JP) 2002-01-23 EP disclosed
EP-1163910-A1 PREVENTIVES/REMEDIES FOR INTERSTITIAL PNEUMONIA AND PULMONARY FIBROSIS Welfide Corporation (JP) 2001-12-19 EP disclosed
EP-1034793-A1 PREVENTIVES/REMEDIES FOR GLAUCOMA Senju Pharmaceutical Co., Ltd. (JP) 2000-09-13 EP 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-20030125351-A1 Agent for prophylaxis and treatment of glaucoma ROCK1, PDE3A, RHOA ROCK2 10/4885ROCK1 1/4885PRKCE 498/4885

“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.