Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.52 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.52 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.52 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6223113 | 0.88 | ALDH1A1 (0.46) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL971971 | 0.87 | ALDH1A1 (0.45) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL1531196 | 0.87 | CYP3A4 (0.53) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL5379822 | 0.78 | GABRA1 (0.39) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL146794 | 0.76 | ALDH1A1 (0.42) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL6279366 | 0.75 | CYP3A4 (0.41) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL27792077 | 0.75 | ALDH1A1 (0.41) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL28195141 | 0.75 | ATM (0.40) | ALDH1A1TSHRTDP1HIF1ALMNA | |
| SCHEMBL9998848 | 0.74 | ALDH1A1 (0.31) | ALDH1A1CYP3A4TSHRTDP1HPGD | |
| SCHEMBL1996062 | 0.73 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRTDP1HPGD |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118184577-A | Phenyl ether meta-amide compound and application thereof | 山东省农药科学研究院 | 2024-06-14 | — | — | CN | claimed |
| CN-105218645-B | A kind of Caspofungin impurity C of high-purity high-yield0Preparation method | 成都雅途生物技术有限公司 | 2018-08-07 | — | — | CN | claimed |
| CN-105218645-A | A kind of Caspofungin impurity C of high-purity high-yield 0preparation method | YACHT BIOTECHNOLOGY COMPANY | 2016-01-06 | — | — | CN | claimed |
| US-4335133-A | BACTERICIDES, FUNGICIDES | CHEVRON RESEARCH COMPANY (US) | 1982-06-15 | — | — | US | claimed |
| US-4271306-A | FUNGICIDES, BACTERICIDES | CHEVRON RESEARCH COMPANY (US) | 1981-06-02 | — | — | US | claimed |
| CN-118184577-A | Phenyl ether meta-amide compound and application thereof | 山东省农药科学研究院 | 2024-06-14 | — | — | CN | disclosed |
| CN-112110985-B | 6- (acetyl-Arg-Gly-Asp-AA-sulfhydryl) purine, synthesis, activity and application thereof | 首都医科大学 | 2022-09-02 | — | — | CN | disclosed |
| CN-112110986-B | 6-acetyl RGD mercaptopurine, synthesis thereof, activity of combination of 6-acetyl RGD mercaptopurine and cisplatin and application of 6-acetyl RGD mercaptopurine | 首都医科大学 | 2022-04-22 | — | — | CN | disclosed |
| CN-112110986-A | 6-acetyl RGD mercaptopurine, synthesis thereof, activity of combination of 6-acetyl RGD mercaptopurine and cisplatin and application of 6-acetyl RGD mercaptopurine | 首都医科大学 | 2020-12-22 | — | — | CN | disclosed |
| CN-105218645-B | A kind of Caspofungin impurity C of high-purity high-yield0Preparation method | 成都雅途生物技术有限公司 | 2018-08-07 | — | — | CN | disclosed |
| CN-105218645-A | A kind of Caspofungin impurity C of high-purity high-yield 0preparation method | YACHT BIOTECHNOLOGY COMPANY | 2016-01-06 | — | — | CN | disclosed |
| CN-103524441-A | Compound comprising triazole structure, preparation method thereof and application of compound taken as weed killer | UNIV CHINA AGRICULTURAL | 2014-01-22 | — | — | CN | disclosed |
| EP-0731801-B1 | SUBSTITUTED AMINOALKYLAMINOPYRIDINES | BYK GULDEN LOMBERG CHEM FAB (DE) | 2001-10-24 | — | — | EP | disclosed |
| US-5369116-A | Polyfluorinated thiazoline derivative and chemical for controlling noxious organisms containing the same | UBE INDUSTRIES, LTD. (JP) | 1994-11-29 | — | — | US | disclosed |
| US-5288733-A | Quinolylmethoxyphenylacetic acid acylamides and ureas | BAYER AKTIENGESELLSCHAFT (DE) | 1994-02-22 | — | — | US | disclosed |
| US-5266578-A | Lipoxygenase inhibitors | BAYER AKTIENGESELLSCHAFT (DE) | 1993-11-30 | — | — | US | disclosed |
| EP-0096905-B1 | PROCESS FOR THE PREPARATION OF GLYCOL ALDEHYDE | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-04-23 | — | — | EP | disclosed |
| EP-0096905-A1 | Process for the preparation of glycol aldehyde | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1983-12-28 | — | — | EP | disclosed |
| US-4335133-A | BACTERICIDES, FUNGICIDES | CHEVRON RESEARCH COMPANY (US) | 1982-06-15 | — | — | US | disclosed |
| US-4271306-A | FUNGICIDES, BACTERICIDES | CHEVRON RESEARCH COMPANY (US) | 1981-06-02 | — | — | US | disclosed |