Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.42 |
| ▸ | CA2 | P00918 | 8/20 | 0.42 |
| ▸ | CA7 | P43166 | 8/20 | 0.42 |
| ▸ | CA9 | Q16790 | 8/20 | 0.42 |
| ▸ | CA4 | P22748 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21052525 | 0.85 | CA1 (0.55) | CA1CA2CA7CA9CA4 | |
| SCHEMBL21090845 | 0.74 | APAF1 (0.39) | CA1CA2CA7CA9CA4 | |
| SCHEMBL25699110 | 0.72 | ALK (0.33) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL12856856 | 0.71 | ALDH1A1 (0.67) | CA1CA2CA7CA9ALDH1A1 | |
| SCHEMBL6385626 | 0.69 | NPC1 (0.50) | ALDH1A1L3MBTL1ALOX12RECQLTSHR | |
| SCHEMBL11519236 | 0.69 | PPOX (0.50) | ALDH1A1TDP1MAPT | |
| SCHEMBL9100646 | 0.68 | NPC1 (0.48) | ALDH1A1L3MBTL1ALOX12RECQLTSHR | |
| SCHEMBL17183763 | 0.68 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1ALOX12RECQLTSHR | |
| SCHEMBL17201467 | 0.67 | ALK (0.43) | ALDH1A1TSHRTRPA1ALKTDP1 | |
| SCHEMBL20814168 | 0.67 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TSHRMAPK1APAF1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230201799-A1 | Macromolecular compositions comprising indene-derivatives, preparation thereof, and use thereof | STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) | 2023-06-29 | — | — | US | disclosed |