Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL11427100 | 0.92 | PARP1 (0.41) | PARP1KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL11258136 | 0.82 | CYP3A4 (0.42) | PARP1KMT2AMEN1NPC1KDM4E | |
| SCHEMBL11668348 | 0.74 | ALDH1A1 (0.39) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL11419267 | 0.68 | HTR1A (0.36) | PARP1TACR1HSD17B10 | |
| SCHEMBL28325886 | 0.68 | PARP1 (0.37) | PARP1KMT2ARAB9AL3MBTL1KDM4E | |
| SCHEMBL11221731 | 0.67 | ALOX15 (0.39) | PARP1KMT2AMEN1L3MBTL1KDM4E | |
| SCHEMBL11674018 | 0.67 | SLC6A4 (0.48) | — | |
| SCHEMBL11674029 | 0.66 | HTT (0.42) | PARP1KMT2AMEN1KDM4EALDH1A1 | |
| SCHEMBL27554114 | 0.66 | PARP1 (0.50) | PARP1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL7289989 | 0.65 | MAOA (0.38) | TACR1TSHR |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4340768-A | COPPER CATALYZED HYDROLYSIS OF 4,4*-DIBROMO BIPHENYL | HODOGAYA CHEMICAL CO., LTD. (JP) | 1982-07-20 | — | — | US | claimed |
| CN-106431859-B | A kind of technique that cyclohexanol dehydrogenation prepares cyclohexanone | 长沙兴和新材料有限公司 | 2019-01-15 | — | — | CN | disclosed |
| CN-105754099-B | Composition and polymer | 旭化成株式会社 | 2018-09-18 | — | — | CN | disclosed |
| CN-105030750-B | Application of one group of cajanin structurally similar compounds in anti-hepatitis C virus and anti AIDS virus | 中国医学科学院医药生物技术研究所 | 2018-08-28 | — | — | CN | disclosed |
| CN-105498542-B | The method for extracting lithium isotope | 中国科学院青海盐湖研究所 | 2017-07-28 | — | — | CN | disclosed |
| CN-106866722-A | A kind of organo-silicon compound containing benzocyclobutene functionalization and preparation method thereof | 复旦大学 | 2017-06-20 | — | — | CN | disclosed |
| CN-106083557-A | α, β unsaturation cyclohexanone derivative and application thereof | 武汉理工大学 | 2016-11-09 | — | — | CN | disclosed |
| CN-103502315-B | Composition and polymer | 旭化成株式会社 | 2016-08-17 | — | — | CN | disclosed |
| CN-103172512-B | A group of compounds with similar cajanin structure, preparation method and application | 中国医学科学院医药生物技术研究所 | 2016-08-03 | — | — | CN | disclosed |
| CN-105754099-A | Composition and polymer | 旭化成株式会社 | 2016-07-13 | — | — | CN | disclosed |
| CN-1674782-A | Composition | SYNGENTA LTD (GB) | 2005-09-28 | — | — | CN | disclosed |
| US-4351942-A | Isochromans | AMERICAN HOME PRODUCTS CORP. (US) | 1982-09-28 | — | — | US | disclosed |
| US-4223151-A | 4-(6,7-DIMETHOXY-1-METHYL-ISOCHROMAN-1-YL)PYRIDINE | AMERICAN HOME PRODUCTS CORPORATION (US) | 1980-09-16 | — | — | US | disclosed |
| US-4123252-A | Methoxy substituted cycloalkanapyrazole herbicides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-10-31 | — | — | US | disclosed |
| US-4111681-A | CYCLOALKANAPYRAZOLE-3-CARBONITRILE HERBICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-09-05 | — | — | US | disclosed |
| US-4108628-A | Cycloalkanopyrazole herbicides mixtures | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-08-22 | — | — | US | disclosed |
| US-4059434-A | Cycloalkanapyrazole herbicides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-11-22 | — | — | US | disclosed |
| US-4036842-A | FRIEDEL CRAFTS CATALYST | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-07-19 | — | — | US | disclosed |
| US-4021451-A | P-(3,4-DIHYDRO-1-METHYL-1H-(1)BENZOTHIENO(2,3-C)PYRAN-1-YL)PHENYL) -ACETIC ACID | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-05-03 | — | — | US | disclosed |
| US-4017501-A | Process for preparing pyridinium chloride salts of alkyl esters of 2-chloro-N-2-hydroxyethylacetamide | AMERICAN CYANAMID COMPANY (US) | 1977-04-12 | — | — | US | disclosed |