Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13744553 | 0.64 | ACHE (0.72) | GAAACHEALDH1A1KMT2AHPGD | |
| SCHEMBL13744784 | 0.63 | L3MBTL1 (0.73) | GAAACHEALDH1A1HPGDTP53 | |
| SCHEMBL13450004 | 0.63 | APOBEC3A (0.55) | ACHEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30674443 | 0.63 | GAA (0.62) | GAAALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL10722678 | 0.63 | ACHE (0.82) | ACHEALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL771850 | 0.62 | GAA (0.53) | GAAACHEALDH1A1MEN1KMT2A | |
| SCHEMBL470967 | 0.62 | GAA (1.00) | GAAACHEALDH1A1MEN1CYP3A4 | |
| SCHEMBL10040471 | 0.62 | GAA (0.69) | GAAALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL5650037 | 0.62 | CYP1A2 (0.47) | ALDH1A1MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5652348 | 0.62 | TP53 (0.43) | ALDH1A1MEN1CYP1A2CYP2C9CYP2C19 |
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-2011068881-A1 | NOVEL TRICYCLIC COMPOUNDS | ABBOTT LABORATORIES (US) | 2011-06-09 | — | — | WO | disclosed |