Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 7/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.30 |
| ▸ | DGKA | P23743 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28187359 | 0.92 | ALDH1A1 (0.39) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL28052200 | 0.92 | ALDH1A1 (0.44) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL28268150 | 0.90 | ALDH1A1 (0.38) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL28269818 | 0.89 | NAAA (0.42) | TSHRALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL28037179 | 0.87 | NAAA (0.44) | ACHETSHRALDH1A1ATMHCAR2 | |
| SCHEMBL28132615 | 0.87 | ALDH1A1 (0.40) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL131236 | 0.86 | ALDH1A1 (0.39) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL28141874 | 0.85 | ALDH1A1 (0.37) | ACHETSHRALDH1A1ATMTDP1 | |
| SCHEMBL28187989 | 0.84 | ALDH1A1 (0.34) | TSHRALDH1A1ATMTDP1L3MBTL1 | |
| SCHEMBL28000225 | 0.84 | ALDH1A1 (0.36) | TSHRALDH1A1ATMTDP1L3MBTL1 |
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-105646637-A | Abiraterone derivative, preparation method and medical applications thereof | 四川海思科制药有限公司 | 2016-06-08 | — | — | CN | disclosed |