Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 6/20 | 0.30 |
| ▸ | ERN1 | O75460 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9697580 | 0.89 | CASP1 (0.37) | TSHRCASP1ERN1MEN1KMT2A | |
| SCHEMBL13209021 | 0.89 | CA1 (0.37) | ALDH1A1MEN1KMT2A | |
| SCHEMBL9697565 | 0.87 | CASP1 (0.32) | ALDH1A1CASP1ACHEERN1MEN1 | |
| SCHEMBL9699402 | 0.80 | CASP1 (0.37) | ALDH1A1CASP1ERN1MEN1KMT2A | |
| SCHEMBL8218205 | 0.80 | TSHR (0.35) | TSHR | |
| SCHEMBL9697624 | 0.80 | ACHE (0.35) | ALDH1A1BRD4ACHEERN1 | |
| SCHEMBL9697877 | 0.78 | TSHR (0.34) | TSHR | |
| SCHEMBL16609594 | 0.77 | ACHE (0.42) | TSHRALDH1A1BRD4ACHEERN1 | |
| SCHEMBL9697777 | 0.77 | — | — | |
| SCHEMBL13055388 | 0.73 | MAPT (0.42) | TSHRCASP1ACHEERN1MEN1 |
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-1992002521-A1 | 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-02-20 | — | — | WO | disclosed |