Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | CCR4 | P51679 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| 1,2-Dichlorobenzene SCHEMBL27998012 | 0.88 | TSHR (0.42) | ALDH1A1LMNATSHRKMT2A | |
| Methanesulfonic Acid Ethyl Ester SCHEMBL27999978 | 0.80 | PSIP1 (0.39) | ALDH1A1LMNASMN1; SMN2PTGS2TSHR | |
| Methanesulfonic Acid Ethyl Ester SCHEMBL27623177 | 0.78 | TSHR (0.44) | ALDH1A1LMNASMN1; SMN2PTGS2TSHR | |
| SCHEMBL4940352 | 0.78 | IDO1 (0.55) | ALDH1A1PNMTIDO1MAPTMEN1 | |
| Methanesulfonic Acid Ethyl Ester SCHEMBL27450293 | 0.76 | CA1 (0.46) | ALDH1A1LMNATSHR | |
| SCHEMBL9830432 | 0.75 | TAAR1 (0.49) | ALDH1A1LMNAMCOLN3PNMTIDO1 | |
| Ether SCHEMBL28856080 | 0.74 | KDM4E (0.47) | ALDH1A1LMNASMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL31373399 | 0.74 | RECQL (0.42) | ALDH1A1LMNASMN1; SMN2RECQLKMT2A | |
| Methanesulfonic Acid Ethyl Ester SCHEMBL27534530 | 0.74 | USP2 (0.43) | ALDH1A1LMNATSHR | |
| Methanesulfonic Acid Ethyl Ester SCHEMBL5533648 | 0.73 | CA1 (0.53) | ALDH1A1LMNATSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105566309-A | Method for synthesizing Luliconazole | HUNAN TRADITIONAL CHINESE MEDICAL COLLEGE | 2016-05-11 | — | — | CN | disclosed |