Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RPA1 | P27694 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28025010 | 0.85 | GAA (0.53) | NR4A2CA12CA1CA2CA7 | |
| SCHEMBL28025015 | 0.85 | NR4A2 (0.50) | NR4A2CA12CA1CA2CA7 | |
| SCHEMBL28207493 | 0.84 | RPA1 (0.48) | KMT2AMAPTKDM4EMEN1GAA | |
| SCHEMBL28206982 | 0.84 | PBRM1 (0.42) | NR4A2CA12CA1CA2CA7 | |
| SCHEMBL28025006 | 0.83 | KDM4E (0.49) | NR4A2CA12CA1CA2CA7 | |
| SCHEMBL28024562 | 0.82 | LMNA (0.52) | MAPTKDM4EGAALMNAALDH1A1 | |
| SCHEMBL28024555 | 0.81 | ALDH1A1 (0.37) | NR4A2KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL20867843 | 0.78 | NR4A2 (0.63) | NR4A2KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL31312746 | 0.76 | NR4A2 (0.50) | NR4A2MAPTGAARPA1MCL1 | |
| SCHEMBL28024557 | 0.72 | NR4A2 (0.49) | NR4A2KMT2AMAPTKDM4EMEN1 |
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-105646327-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | 上海大学 | 2016-06-08 | — | — | CN | disclosed |
| CN-104892485-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | UNIV SHANGHAI | 2015-09-09 | — | — | CN | disclosed |