Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.54 |
| ▸ | CA9 | Q16790 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | PPARG | P37231 | 3/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL8398036 | 1.00 | CA1 (0.54) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL28301338 | 0.98 | CA1 (0.52) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL12256398 | 0.82 | CA1 (0.50) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL8397511 | 0.79 | CA1 (0.47) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL8821206 | 0.78 | CA1 (0.56) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL780030 | 0.78 | CA1 (0.56) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL1128833 | 0.76 | CA1 (0.54) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL6923665 | 0.76 | CA1 (0.54) | CA1CA2CA9KMT2ALMNA | |
| SCHEMBL9638233 | 0.76 | CA2 (0.54) | CA1CA2CA9KMT2ALMNA | |
| Iodide SCHEMBL3347577 | 0.76 | CA1 (0.54) | CA1CA2CA9KMT2ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1423119-A4 | HETEROBICYCLES FKBP-LIGANDS | AGOURON PHARMA (US) | 2005-04-13 | — | — | EP | disclosed |
| EP-1423119-A1 | HETEROBICYCLES FKBP-LIGANDS | Agouron Pharmaceuticals, Inc. (US) | 2004-06-02 | — | — | EP | disclosed |
| WO-2002089806-A1 | HETEROBICYCLES FKBP-LIGANDS | AGOURON PHARMACEUTICALS, INC. (US) | 2002-11-14 | — | — | WO | disclosed |