Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25521916 | 0.82 | ERN1 (0.46) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL25523415 | 0.82 | ERN1 (0.42) | ERN1MAPTKDM4EALOX15MAPK1 | |
| SCHEMBL17334527 | 0.79 | CA12 (0.57) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL25522206 | 0.77 | ERN1 (0.45) | ERN1MAPTKDM4E | |
| SCHEMBL13524662 | 0.77 | ACVR1 (0.50) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL20061111 | 0.76 | CA12 (0.55) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL27771687 | 0.75 | ACVR1 (0.52) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL25523411 | 0.75 | AAK1 (0.44) | ACVR1AAK1 | |
| SCHEMBL25521412 | 0.74 | PIK3CD (0.42) | ERN1KDM4E | |
| SCHEMBL25521416 | 0.74 | AKR1C3 (0.45) | NPC1RAB9AMCL1KDM4ECASP1 |
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-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |