Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | HTT | P42858 | 2/20 | 0.69 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.54 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | CYP2A13 | Q16696 | 3/20 | 0.53 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18360630 | 0.89 | KDM4E (0.60) | KDM4EHTTHRH3HRH4ALOX15 | |
| SCHEMBL15081988 | 0.87 | KDM4E (0.57) | KDM4EHTTHRH3HRH4ALOX15 | |
| SCHEMBL23507326 | 0.83 | CXCR4 (0.60) | KDM4EHTTSIGMAR1CYP2A13CXCR4 | |
| SCHEMBL18360639 | 0.83 | CXCR4 (0.60) | KDM4EHTTSIGMAR1CYP2A13CXCR4 | |
| SCHEMBL7372983 | 0.81 | KDM4E (1.00) | KDM4EHTTSIGMAR1CYP2A13CXCR4 | |
| SCHEMBL25740928 | 0.81 | ALDH1A1 (0.60) | KDM4EHTTHSD17B10SIGMAR1CYP2A13 | |
| SCHEMBL15084351 | 0.81 | ACHE (0.65) | KDM4EHTTHRH3HRH4CYP2A13 | |
| SCHEMBL12013926 | 0.79 | CXCR4 (0.69) | KDM4EHTTSIGMAR1CYP2A13CXCR4 | |
| SCHEMBL15084375 | 0.79 | ALDH1A1 (0.54) | KDM4EHTTHRH3HRH4CYP2A13 | |
| SCHEMBL15084377 | 0.79 | ALDH1A1 (0.54) | KDM4EHTTHRH3HRH4CYP2A13 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2615916-B1 | FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS | MERCK SHARP & DOHME (US) | 2017-01-04 | — | — | EP | disclosed |