Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.55 |
| ▸ | CA2 | P00918 | 3/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA7 | P43166 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.55 |
| ▸ | XDH | P47989 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18670723 | 1.00 | CA1 (0.55) | CA1CA2CA12CA7CA9 | |
| SCHEMBL10215462 | 0.79 | SLC6A2 (0.56) | CA1CA2CA12CA7CA9 | |
| SCHEMBL11152269 | 0.79 | SLC6A2 (0.56) | CA1CA2CA12CA7CA9 | |
| SCHEMBL13550876 | 0.77 | CA1 (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL18682153 | 0.77 | CHRNA1 (0.53) | MAPTALDH1A1HPGDTDP1LMNA | |
| SCHEMBL427151 | 0.77 | TSHR (0.71) | CA1CA2CA12CA7CA9 | |
| SCHEMBL17904014 | 0.77 | CA1 (0.47) | CA1CA2CA12CA7CA9 | |
| SCHEMBL11148222 | 0.77 | SLC6A2 (0.51) | CA1CA2CA12CA7CA9 | |
| SCHEMBL10247441 | 0.77 | RARG (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL11526685 | 0.77 | CA1 (0.47) | CA1CA2CA12CA7CA9 |
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-2017053982-A1 | TRIPTYCENE DERIVATIVES FOR NUCLEIC ACID JUNCTION STABILIZATION | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2017-03-30 | — | — | WO | disclosed |