Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | PTGFR | P43088 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19235254 | 0.82 | CCNC (0.43) | CCNCCDK8KDM4EMAPTMEN1 | |
| SCHEMBL9330870 | 0.81 | HCAR2 (0.43) | KDM4ELMNAMAPTMEN1KMT2A | |
| SCHEMBL9845559 | 0.81 | HCAR2 (0.43) | KDM4ELMNAMAPTMEN1KMT2A | |
| SCHEMBL9845672 | 0.81 | HCAR2 (0.43) | KDM4ELMNAMAPTMEN1KMT2A | |
| SCHEMBL7928592 | 0.74 | PTGER3 (0.50) | TBXA2RPTGER4PTGFRPTGER3PTGER2 | |
| SCHEMBL7824273 | 0.74 | PTGER3 (0.50) | TBXA2RPTGER4PTGFRPTGER3PTGER2 | |
| SCHEMBL11371545 | 0.70 | PTPN7 (0.45) | CES2CES1MAPTMEN1KMT2A | |
| Naphthalene SCHEMBL2834571 | 0.70 | HCAR2 (0.56) | KDM4ELMNAMAPTKMT2AALDH1A1 | |
| Naphthalene SCHEMBL2834576 | 0.70 | HCAR2 (0.56) | KDM4ELMNAMAPTKMT2AALDH1A1 | |
| SCHEMBL238071 | 0.69 | CYP2A6 (0.39) | ESR1CES2CES1LMNATDP1 |
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-3411361-B1 | NRF2 ACTIVATING COMPOUNDS AND USES THEREOF | RIGEL PHARMACEUTICALS INC (US) | 2020-11-25 | — | — | EP | disclosed |