Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.47 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.43 |
| ▸ | LPL | P06858 | 1/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6227853 | 0.98 | HRH3 (0.66) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL10953965 | 0.82 | HRH3 (0.88) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL20606159 | 0.80 | ALDH1A1 (0.56) | HRH3POLBHDAC1CXCR4ALDH1A1 | |
| SCHEMBL9720678 | 0.79 | HRH3 (0.69) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL3862351 | 0.78 | HRH3 (0.72) | HRH3POLBHDAC1CXCR4CXCL12 | |
| Hydrochloric Acid SCHEMBL8812435 | 0.76 | HRH3 (0.70) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL3979245 | 0.76 | HDAC6 (0.57) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL10073807 | 0.76 | MEN1 (0.69) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL11434269 | 0.76 | HRH3 (0.69) | HRH3POLBHDAC1CXCR4CXCL12 | |
| SCHEMBL5528908 | 0.76 | HRH3 (0.69) | HRH3POLBHDAC1CXCR4CXCL12 |
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-2017220431-A1 | FUSED PYRAZOLE DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2017-12-28 | — | — | WO | disclosed |