Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 4/20 | 0.59 |
| ▸ | LTA4H | P09960 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.52 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.52 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.52 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.52 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.52 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15448720 | 1.00 | SRD5A2 (0.59) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL3020544 | 1.00 | SRD5A2 (0.59) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL2862520 | 1.00 | SRD5A2 (0.59) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL27605858 | 0.94 | SRD5A2 (0.53) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL17668667 | 0.94 | BCL2L1 (0.55) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL2188901 | 0.92 | PARP10 (0.58) | SRD5A2LTA4HALDH1A1MAPTHPGD | |
| SCHEMBL7929154 | 0.92 | SRD5A2 (0.67) | SRD5A2ALDH1A1HPGDPARP10LMNA | |
| SCHEMBL9814841 | 0.92 | SRD5A2 (0.72) | SRD5A2LTA4HALDH1A1HPGDPARP10 | |
| SCHEMBL18657389 | 0.90 | SRD5A2 (0.50) | SRD5A2LTA4HCES2CES1ALDH1A1 | |
| SCHEMBL9777083 | 0.90 | HPGD (0.59) | SRD5A2LTA4HALDH1A1HPGDLMNA |
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-110143932-A | Piperazinone derivs and preparation method thereof, inhibitor and the method for preventing and treating root parasitism weeds | 南开大学 | 2019-08-20 | — | — | CN | disclosed |