Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 2/20 | 0.42 |
| ▸ | HTR1B | P28222 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17444569 | 0.83 | KDM4E (0.70) | KDM4EHPGDALDH1A1THRBKMT2A | |
| SCHEMBL17444608 | 0.83 | KDM4E (0.65) | KDM4EHPGDALDH1A1THRBKMT2A | |
| SCHEMBL18889429 | 0.82 | AHR (0.40) | AHRKDM4EHPGDALDH1A1THRB | |
| SCHEMBL29152795 | 0.82 | KMT2A (0.56) | AHRKDM4EHPGDALDH1A1TRPM8 | |
| SCHEMBL18906772 | 0.81 | ALDH1A1 (0.44) | AHRKDM4EHPGDALDH1A1THRB | |
| SCHEMBL18941237 | 0.81 | KMT2A (0.66) | KDM4EHPGDALDH1A1THRBKMT2A | |
| SCHEMBL18941063 | 0.79 | KMT2A (0.64) | KMT2AMAPTMEN1RAB9ATP53 | |
| SCHEMBL4374342 | 0.79 | ALDH1A1 (0.68) | KDM4EHPGDALDH1A1KMT2AMAPT | |
| SCHEMBL4536453 | 0.78 | MAPT (0.43) | AHRKDM4EHPGDALDH1A1THRB | |
| SCHEMBL18263044 | 0.78 | RAB9A (0.57) | KDM4EHPGDALDH1A1THRBKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110878099-B | Preparation method of pyrrole [1,2, alpha ] indole alkaloid derivative | 五邑大学 | 2021-11-30 | — | — | CN | disclosed |
| CN-110878099-A | Preparation method of pyrrole [1,2, α ] indole alkaloid derivative | 五邑大学 | 2020-03-13 | — | — | CN | disclosed |