Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.48 |
| ▸ | HTR3B | O95264 | 3/20 | 0.48 |
| ▸ | HTR3A | P46098 | 3/20 | 0.48 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.48 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27743313 | 0.74 | ALOX5 (0.48) | ALOX5ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL28103279 | 0.72 | ALOX5 (0.46) | ALOX5ALDH1A1TSHRALOX15GAA | |
| SCHEMBL27380663 | 0.71 | ALOX5 (0.44) | ALOX5HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL27671224 | 0.70 | ALOX5 (0.41) | ALOX5HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL28103547 | 0.68 | ADRB2 (0.41) | ALDH1A1KDM4EMAPT | |
| SCHEMBL28039321 | 0.68 | ADRB1 (0.45) | ALDH1A1CYP2D6L3MBTL1MAPT | |
| SCHEMBL6581630 | 0.67 | ALOX5 (0.64) | ALOX5ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL28063442 | 0.67 | CHRNB2 (0.43) | — | |
| SCHEMBL28103502 | 0.67 | ALOX5 (0.47) | ALOX5ALDH1A1KMT2AMEN1GAA | |
| SCHEMBL615260 | 0.65 | HTR3E (1.00) | ALOX5ALDH1A1HTR3EHTR3BHTR3A |
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-1070185-C | Preparation method of N-substituted 3-hydroxypyrazole compound | BASF AG (DE) | 2001-08-29 | — | — | CN | disclosed |
| CN-1190961-A | Process for producing N-substituted 3-hydroxypyrazoles | BASF AG (DE) | 1998-08-19 | — | — | CN | disclosed |