Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5168491 | 0.76 | — | — | |
| SCHEMBL27802394 | 0.75 | CA2 (0.36) | CA1CA2CYP1A2 | |
| SCHEMBL1252195 | 0.74 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL28179517 | 0.73 | CA1 (0.32) | CA1CA2 | |
| SCHEMBL17617125 | 0.73 | ALDH1A1 (0.42) | CA1CA2CA7CA14CYP1A2 | |
| SCHEMBL13690831 | 0.73 | CA1 (0.47) | CA1CA2CA7CA14 | |
| SCHEMBL1275780 | 0.73 | TSHR (0.35) | CA1CA2CA7CA14 | |
| SCHEMBL17617121 | 0.73 | ALDH1A1 (0.42) | CA1CA2CA7CA14CYP1A2 | |
| SCHEMBL17617142 | 0.73 | ALDH1A1 (0.42) | CA1CA2CA7CA14CYP1A2 | |
| SCHEMBL6238166 | 0.71 | TSHR (0.33) | CA1CA2CA7CA14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004074316-A1 | CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOGS | GILON CHAIM (IL) | 2004-09-02 | — | — | WO | disclosed |
| EP-0804468-A1 | CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOG | PEPTOR LTD (IL) | 1997-11-05 | — | — | EP | disclosed |
| WO-1995033765-A1 | CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOG | PEPTOR LTD. (IL) | 1995-12-14 | — | — | WO | disclosed |