Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 8/20 | 0.48 |
| ▸ | CES1 | P23141 | 7/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14855512 | 0.80 | TDP1 (0.47) | CES2CES1RAB9AALDH1A1TDP1 | |
| SCHEMBL3664782 | 0.77 | NPSR1 (0.46) | RAB9AALDH1A1TDP1MAPK1NPSR1 | |
| Hydrochloric Acid SCHEMBL7127166 | 0.75 | NPSR1 (0.44) | RAB9AALDH1A1TDP1MAPK1NPSR1 | |
| SCHEMBL3258421 | 0.74 | NPSR1 (0.43) | RAB9AALDH1A1TDP1MAPK1NPSR1 | |
| SCHEMBL11686030 | 0.74 | NPSR1 (0.43) | RAB9AALDH1A1TDP1MAPK1NPSR1 | |
| SCHEMBL3248552 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TDP1MAPK1NPSR1TSHR | |
| Benzil SCHEMBL27886482 | 0.72 | CES2 (0.58) | CES2CES1RAB9AALDH1A1TDP1 | |
| SCHEMBL7362600 | 0.72 | F2 (0.43) | ALDH1A1TDP1MAPK1NPSR1TSHR | |
| SCHEMBL6642554 | 0.71 | NPSR1 (0.45) | RAB9AALDH1A1NPSR1TSHRKMT2A | |
| Benzil SCHEMBL27959224 | 0.69 | CES2 (0.78) | CES2CES1RAB9AALDH1A1TDP1 |
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-115087650-A | Substituted thiophenecarboxamides and derivatives thereof as microbiocides | 拜耳公司 | 2022-09-20 | — | — | CN | disclosed |