Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol
The experimentally established mechanism targets of Maleic Acid. 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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.53 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.53 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL10620517 | 1.00 | TSHR (0.53) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Maleic Acid SCHEMBL27485086 | 1.00 | TSHR (0.53) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Maleic Acid SCHEMBL27625900 | 0.86 | TSHR (0.39) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Crotonic Acid SCHEMBL14862804 | 0.85 | HCAR2 (0.36) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Crotonic Acid SCHEMBL14862805 | 0.85 | HCAR2 (0.36) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Glyoxylate SCHEMBL4152113 | 0.82 | ALDH1A1 (0.35) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Thiophene SCHEMBL1616682 | 0.81 | — | — | |
| Thiophene SCHEMBL20482064 | 0.81 | CA1 (0.39) | CA1CA2 | |
| Maleic Acid SCHEMBL27583410 | 0.80 | TSHR (0.82) | TSHRTP53EGLN1EGLN3HCAR2 | |
| Glyoxylate SCHEMBL1443846 | 0.80 | ALDH1A1 (0.33) | HCAR2ALDH1A1 |
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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109991319-A | Timolol class compound and timolol maleate relative substance separation method and its application | 武汉科福新药有限责任公司 | 2019-07-09 | — | — | CN | claimed |
| CN-109475532-A | Combination comprising timolol and an anti-inflammatory agent | 阿尔米雷尔有限公司 | 2019-03-15 | — | — | CN | claimed |
| CN-109475561-A | Composition comprising timolol and its passing through the application in topical treatment rosacea | 阿尔米雷尔有限公司 | 2019-03-15 | — | — | CN | claimed |
| CN-104491867-B | A kind of preparation method of the novel Drug Delivery Systems of chitosan package load medicine montmorillonite | 广东药科大学 | 2018-07-17 | — | — | CN | claimed |
| CN-107281094-A | A kind of timolol maleate Pharmaceutical composition and preparation method thereof | 上海奥科达生物医药科技有限公司 | 2017-10-24 | — | — | CN | claimed |
| CN-103977011-B | Travoprost and timolol-containing ophthalmic gel and preparation method thereof | 沈阳兴齐眼药股份有限公司 | 2017-04-19 | — | — | CN | claimed |
| CN-103393483-B | Medicine release method, structure and composition for nose tear system | 玛提治疗有限公司 | 2016-08-24 | — | — | CN | claimed |
| CN-103393496-B | Nasolachrymal drainage system implants for Drug therapy | 玛提治疗有限公司 | 2016-08-17 | — | — | CN | claimed |
| CN-104491867-A | Preparation method of novel administration system with medicine-carrying montmorillonite wrapped by chitosan | UNIV GUANGDONG PHARM | 2015-04-08 | — | — | CN | claimed |
| CN-1698897-A | Pharmaceutical aerosol prepared by trifluorodichloroethane instead of trichlorofluoromethane | HARBIN HENGCANG PHARMACEUTICAL (CN) | 2005-11-23 | — | — | CN | claimed |
| CN-1387846-A | Intraocular pressure reducing agent | SANKYO CO (JP) | 2003-01-01 | — | — | CN | claimed |
| CN-106619573-B | Timolol maleate cubic liquid crystal nanoparticle eye drops and preparation method thereof | 广州中大南沙科技创新产业园有限公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-110177527-A | Device and method for adjusting insertion depth of needle for medicament delivery | 科尼尔赛德生物医学公司 | 2019-08-27 | — | — | CN | disclosed |
| CN-109991319-A | Timolol class compound and timolol maleate relative substance separation method and its application | 武汉科福新药有限责任公司 | 2019-07-09 | — | — | CN | disclosed |
| CN-109966245-A | A kind of brimonidine tartrate gellan gum type situ-gel eye drops and preparation method | 浙江省医学科学院 | 2019-07-05 | — | — | CN | disclosed |
| CN-1418093-A | ultraviolet shielding adhesive preparation | HISAMITSU PHARMACEUTICAL CO (JP) | 2003-05-14 | — | — | CN | disclosed |
| CN-1372463-A | Patches for external use | HISAMITSU PHARMACEUTICAL CO (JP) | 2002-10-02 | — | — | CN | disclosed |
| CN-1311667-A | Intestinal target site-releasing preparation | TANABE SEIYAKU CO (JP) | 2001-09-05 | — | — | CN | disclosed |
| CN-1291898-A | Remedies for corneal epithelium disturbance | WAKAMOTO PHARMA CO LTD (JP) | 2001-04-18 | — | — | CN | disclosed |
| US-4732887-A | RESIN IN VOIDS FOR CHROMATOGRAPHY | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1988-03-22 | — | — | US | disclosed |