Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL20605026 | 0.84 | MYC (0.47) | XDHCYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL27648661 | 0.73 | BRPF1 (0.39) | CYP1A2CYP3A4CYP2C19NR4A2RAB9A | |
| SCHEMBL27651981 | 0.72 | NR4A2 (0.63) | ALDH1A1NR4A2LMNAKDM4EHSD17B10 | |
| SCHEMBL30689179 | 0.71 | MAPT (0.45) | XDHCYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL27984527 | 0.69 | NR4A2 (0.63) | ALDH1A1MAPTNR4A2LMNAKDM4E | |
| SCHEMBL25070379 | 0.69 | NR1I2 (0.59) | XDHCYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL29209733 | 0.68 | ALDH1A1 (0.36) | XDHCYP3A4ALDH1A1MAPT | |
| SCHEMBL27545498 | 0.68 | NR4A2 (0.40) | NR4A2LMNAKDM4EHSD17B10RAB9A | |
| SCHEMBL27737996 | 0.68 | CFTR (0.32) | RAB9A | |
| SCHEMBL12748347 | 0.67 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C19ALDH1A1NR4A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029647-A | Glucose transport inhibitors | 拜耳制药股份公司 | 2016-10-12 | — | — | CN | disclosed |