Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 4/20 | 0.93 |
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.48 |
| ▸ | ESR2 known ✓ | Q92731 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.93 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.93 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 6/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Water SCHEMBL10589317 | 1.00 | TDP1 (0.93) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Water SCHEMBL3137651 | 1.00 | TDP1 (0.93) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Hydrochloric Acid SCHEMBL6650565 | 0.97 | TDP1 (0.88) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Hydrochloric Acid SCHEMBL30078382 | 0.97 | TDP1 (0.88) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Hydrochloric Acid SCHEMBL866164 | 0.97 | TDP1 (0.88) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Hydrochloric Acid SCHEMBL28836366 | 0.97 | TDP1 (0.88) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| SCHEMBL23855 | 0.97 | TDP1 (1.00) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| SCHEMBL29349835 | 0.97 | TDP1 (1.00) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| SCHEMBL8745318 | 0.93 | TDP1 (0.93) | TDP1KMT2AMEN1KCNH2CYP3A4 | |
| Methane SCHEMBL1599658 | 0.93 | TDP1 (0.93) | TDP1KMT2AMEN1KCNH2CYP3A4 |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11597694-B2 | Method for producing lactic acid and method for producing polylactic acid | TORAY INDUSTRIES, INC. (JP) | 2023-03-07 | — | — | US | disclosed |
| US-20200325097-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | TORAY INDUSTRIES, INC. (JP) | 2020-10-15 | — | — | US | disclosed |
| US-10683254-B2 | Method for producing lactic acid and method for producing polylactic acid | TORAY INDUSTRIES, INC. (JP) | 2020-06-16 | — | — | US | disclosed |
| EP-3147275-B1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | TORAY INDUSTRIES (JP) | 2019-10-23 | — | — | EP | disclosed |
| EP-2840150-B1 | Method for producing sugar liquid | TORAY INDUSTRIES (JP) | 2019-10-16 | — | — | EP | disclosed |
| US-20180291151-A1 | Functionalized Polyamides And Methods Of Preparing The Same | FIRESTONE FIBERS & TEXTILES COMPANY, LLC | 2018-10-11 | — | — | US | disclosed |
| US-10093747-B2 | Method for production sugar liquid | TORAY INDUSTRIES, INC. (JP) | 2018-10-09 | — | — | US | disclosed |
| EP-3147275-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | TORAY INDUSTRIES, INC. (JP) | 2017-03-29 | — | — | EP | disclosed |
| EP-2263996-B1 | PROCESS FOR PRODUCING DIAMINE AND POLYAMIDE | TORAY INDUSTRIES (JP) | 2016-09-14 | — | — | EP | disclosed |
| EP-2692872-B1 | METHOD FOR MANUFACTURING SUGAR SOLUTION | TORAY INDUSTRIES (JP) | 2015-12-30 | — | — | EP | disclosed |
| US-8334411-B2 | Process for producing diamine and polyamide | TORAY INDUSTRIES, INC. (JP) | 2012-12-18 | — | — | US | disclosed |
| US-20110263811-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | TORAY INDUSTRIES, INC. (JP) | 2011-10-27 | — | — | US | disclosed |
| US-20110250637-A1 | METHOD FOR PRODUCING SUGAR LIQUID | TORAY INDUSTRIES, INC. (JP) | 2011-10-13 | — | — | US | disclosed |
| EP-2374895-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | Toray Industries, Inc. (JP) | 2011-10-12 | — | — | EP | disclosed |
| EP-2371973-A1 | METHOD FOR PRODUCING SUGAR LIQUID | Toray Industries, Inc. (JP) | 2011-10-05 | — | — | EP | disclosed |
| US-20110004018-A1 | PROCESS FOR PRODUCING DIAMINE AND POLYAMIDE | TORAY INDUSTRIES, INC. (JP) | 2011-01-06 | — | — | US | disclosed |
| EP-2263996-A1 | PROCESS FOR PRODUCING DIAMINE AND POLYAMIDE | Toray Industries, Inc. (JP) | 2010-12-22 | — | — | EP | disclosed |
| US-20100190222-A1 | LACTIC ACID PRODUCTION METHOD | TORAY INDUSTRIES, INC. (JP) | 2010-07-29 | — | — | US | disclosed |
| EP-2175029-A1 | LACTIC ACID PRODUCTION METHOD | Toray Industries, Inc. (JP) | 2010-04-14 | — | — | EP | disclosed |
| EP-0538850-B1 | New polyurea resins and their preparation and use | IHARA CHEMICAL IND CO (JP) | 1997-01-22 | — | — | 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 (5 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20110263811-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | MLEC, FIBP, LDHA | MEN1 1090/4885THRB 4591/4885ESR2 4843/4885 |
| US-11597694-B2 | Method for producing lactic acid and method for producing polylactic acid | MLEC, FIBP, LDHA | MEN1 1090/4885THRB 4591/4885ESR2 4843/4885 |
| US-10683254-B2 | Method for producing lactic acid and method for producing polylactic acid | MLEC, FIBP, LDHA | MEN1 1090/4885THRB 4591/4885ESR2 4843/4885 |
| US-20110004018-A1 | PROCESS FOR PRODUCING DIAMINE AND POLYAMIDE | NAAA, PUF60, DNPEP | MEN1 1022/4885THRB 4383/4885ESR2 4800/4885 |
| US-20200325097-A1 | METHOD FOR PRODUCING LACTIC ACID AND METHOD FOR PRODUCING POLYLACTIC ACID | MLEC, FIBP, LDHA | MEN1 1090/4885THRB 4591/4885ESR2 4843/4885 |
“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.