Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL8813613 | 0.84 | UGT2B7 (0.33) | HTTPOLBCYP19A1CA1CA2 | |
| SCHEMBL4135825 | 0.79 | ALDH1A1 (0.40) | HTTALDH1A1 | |
| SCHEMBL4359741 | 0.78 | TRPA1 (0.41) | ALDH1A1TDP1PTPN2PTPN1 | |
| SCHEMBL14248383 | 0.75 | ALDH1A1 (0.41) | HTTALDH1A1 | |
| SCHEMBL25137147 | 0.70 | CA1 (0.39) | POLBCYP19A1CA1CA2CA4 | |
| SCHEMBL4254045 | 0.70 | CA1 (0.39) | POLBCYP19A1CA1CA2CA4 | |
| SCHEMBL8380889 | 0.69 | CYP2C19 (0.30) | — | |
| SCHEMBL9122284 | 0.69 | PTPN1 (0.39) | HTTALDH1A1TDP1PTPN1POLB | |
| SCHEMBL17609884 | 0.68 | CA1 (0.33) | POLBCYP19A1CA1CA2CA4 | |
| SCHEMBL31389834 | 0.68 | CA1 (0.33) | POLBCYP19A1CA1CA2CA4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55105639-A | — | — | None | — | — | JP | disclosed |
| JP-S55105639-A | PREPARATION OF GAMMA-DAMASCONE | TOYOTAMA KORYO KK | 1980-08-13 | — | — | JP | disclosed |