Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.50 |
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | HNF4A | P41235 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTR7 | P34969 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | SRD5A1 | P18405 | 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 | |
|---|---|---|---|---|
| SCHEMBL31158183 | 0.83 | HSP90AA1 (0.50) | HSP90AA1SRD5A2PNMTCYP2C9TSHR | |
| SCHEMBL3720118 | 0.83 | HSP90AA1 (0.50) | HSP90AA1SRD5A2PNMTCYP2C9TSHR | |
| SCHEMBL29638295 | 0.81 | HSP90AA1 (0.67) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| SCHEMBL67699 | 0.81 | HSP90AA1 (0.67) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| SCHEMBL31229252 | 0.81 | HSP90AA1 (0.67) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| Hydrochloric Acid SCHEMBL6755698 | 0.79 | HSP90AA1 (0.65) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| SCHEMBL21758198 | 0.79 | HSP90AA1 (0.56) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| SCHEMBL9161973 | 0.78 | HSP90AA1 (0.49) | HSP90AA1SRD5A2PNMTHNF4ACYP2C9 | |
| SCHEMBL21758199 | 0.78 | HSP90AA1 (0.49) | HSP90AA1SRD5A2PNMTCYP2C9TSHR | |
| SCHEMBL11194388 | 0.78 | HSP90AA1 (0.46) | HSP90AA1SRD5A2PNMTCYP2C9TSHR |
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-110612295-A | Pyrazole-3-carboxylic acid amide derivative and pest control agent | 组合化学工业株式会社 | 2019-12-24 | — | — | CN | disclosed |