Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 3/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.48 |
| ▸ | HTR1B | P28222 | 1/20 | 0.48 |
| ▸ | HTR1F | P30939 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16072693 | 0.86 | KMT2A (0.58) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL5814849 | 0.85 | ALDH1A1 (0.44) | KMT2AKDM4EALDH1A1THRBL3MBTL1 | |
| SCHEMBL27487257 | 0.82 | HTR2A (0.53) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL9629984 | 0.82 | KMT2A (0.51) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL10696303 | 0.82 | OXER1 (0.56) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL5444461 | 0.80 | OXER1 (0.64) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL16038911 | 0.80 | KMT2A (0.56) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL13125600 | 0.79 | KMT2A (0.47) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL13125598 | 0.79 | KMT2A (0.48) | KMT2AKDM4EALDH1A1THRBALOX5 | |
| SCHEMBL24877919 | 0.79 | HTR6 (0.76) | KMT2AKDM4EALDH1A1THRBHTR6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104876848-B | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | 南开大学 | 2017-05-17 | — | — | CN | claimed |
| CN-104876848-A | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | UNIV NANKAI | 2015-09-02 | — | — | CN | claimed |
| CN-104876848-B | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | 南开大学 | 2017-05-17 | — | — | CN | disclosed |
| CN-104876848-B | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | 南开大学 | 2017-05-17 | — | — | CN | disclosed |
| CN-104876848-A | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | UNIV NANKAI | 2015-09-02 | — | — | CN | disclosed |
| CN-104876848-A | 1-benzoyl-3-indolyl thioester compound and preparation method thereof | UNIV NANKAI | 2015-09-02 | — | — | CN | disclosed |