Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.35 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18331336 | 0.92 | ALOX5 (0.36) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL18332251 | 0.92 | ALOX5 (0.36) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL18332148 | 0.83 | NOD2 (0.39) | NOD2NOD1RXFP1ALDH1A1TSHR | |
| SCHEMBL10003065 | 0.83 | ALOX5 (0.38) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL10003064 | 0.83 | ALOX5 (0.38) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL10003556 | 0.81 | ALOX5 (0.46) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL16188508 | 0.81 | ALOX5 (0.46) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL10003553 | 0.81 | ALOX5 (0.46) | ALOX5NOD2NOD1ALDH1A1TSHR | |
| SCHEMBL18332144 | 0.80 | NOD2 (0.56) | NOD2NOD1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL21572162 | 0.80 | HPGD (0.33) | ALDH1A1HPGDMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016204261-A1 | AMINOPYRAZOLE DERIVATIVES | 中外製薬株式会社 | 2016-12-22 | — | — | WO | disclosed |