Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.57 |
| ▸ | CES1 | P23141 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | JAK1 | P23458 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28677453 | 0.92 | PTPN11 (0.46) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL26668901 | 0.85 | KDM4E (0.53) | MEN1MAPTKMT2AKDM4EHPGD | |
| SCHEMBL9330930 | 0.84 | KMT2A (0.50) | CES2CES1MEN1KMT2ATDP1 | |
| SCHEMBL4195452 | 0.84 | SMN1; SMN2 (0.61) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL3500245 | 0.80 | CES2 (0.65) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL29459735 | 0.80 | CES2 (0.65) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL777802 | 0.80 | CES2 (0.65) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL556974 | 0.80 | TDP1 (0.44) | CES2CES1TDP1ALDH1A1TP53 | |
| SCHEMBL10050031 | 0.79 | PTPN11 (0.35) | CES2CES1SMN1; SMN2MEN1MAPT | |
| SCHEMBL10388309 | 0.79 | CES2 (0.63) | CES2CES1SMN1; SMN2MEN1MAPT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104961714-A | Synthetic method of alpha,beta-unsaturated butyrolactone | UNIV SOOCHOW | 2015-10-07 | — | — | CN | claimed |
| CN-111978201-B | Synthesis method of N, N' -diaryl benzoyl hydrazine compound | 甘肃农业大学 | 2023-01-03 | — | — | CN | disclosed |
| CN-109776488-B | Synthesis method of alpha-ketoamide compound with ortho-aldehyde group | 江南大学 | 2021-04-27 | — | — | CN | disclosed |
| CN-104961714-B | Synthetic method of alpha,beta-unsaturated butyrolactone | 苏州大学 | 2017-04-19 | — | — | CN | disclosed |
| CN-104961714-A | Synthetic method of alpha,beta-unsaturated butyrolactone | UNIV SOOCHOW | 2015-10-07 | — | — | CN | disclosed |
| CN-102958889-A | Process for producing alpha-ketocarboxylic acid | SUMITOMO CHEMICAL CO | 2013-03-06 | — | — | CN | disclosed |
| US-4562176-A | ANALOGS OF ACTINOMYCIN D | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 1985-12-31 | — | — | US | disclosed |