Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.51 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.49 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.49 |
| ▸ | PFKFB2 | O60825 | 1/20 | 0.48 |
| ▸ | PFKFB1 | P16118 | 1/20 | 0.48 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL10552050 | 0.78 | CSNK2A1 (0.58) | SLC6A4 | |
| SCHEMBL3601687 | 0.78 | IMPDH2 (0.51) | XDHIMPDH2IMPDH1PFKFB2PFKFB1 | |
| SCHEMBL14182961 | 0.75 | IDO1 (0.40) | IMPDH2HASPIN | |
| SCHEMBL19753182 | 0.73 | PIM1 (0.45) | IMPDH2HASPIN | |
| SCHEMBL8410428 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL3298541 | 0.72 | HTR6 (0.56) | XDHCYP2D6 | |
| SCHEMBL15764692 | 0.72 | XDH (0.59) | XDHIMPDH2PFKFB2PFKFB1PFKFB3 | |
| SCHEMBL28429317 | 0.72 | XDH (0.62) | XDHPFKFB2PFKFB1PFKFB3LRRK2 | |
| SCHEMBL273110 | 0.72 | HTR1D (0.56) | SLC6A2CYP2D6 | |
| SCHEMBL2006656 | 0.71 | IMPDH2 (0.56) | XDHIMPDH2IMPDH1PFKFB2PFKFB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111072634-B | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2022-07-22 | — | — | CN | claimed |
| CN-111072634-B | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2022-07-22 | — | — | CN | disclosed |
| CN-111072634-A | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2020-04-28 | — | — | CN | disclosed |