Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21753573 | 0.84 | RAB9A (0.41) | SIGMAR1POLBGAAALDH1A1RAB9A | |
| SCHEMBL21753515 | 0.73 | MEN1 (0.42) | POLBALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL5357866 | 0.72 | LMNA (0.69) | SIGMAR1POLBGAAALDH1A1RAB9A | |
| SCHEMBL21753506 | 0.68 | RAB9A (0.37) | ALDH1A1RAB9ACYP2C19 | |
| SCHEMBL21753508 | 0.68 | RAB9A (0.37) | ALDH1A1RAB9ACYP2C19 | |
| SCHEMBL18499055 | 0.67 | GAA (0.50) | POLBGAAALDH1A1RAB9ATDP1 | |
| SCHEMBL5220726 | 0.66 | MAPK1 (0.50) | POLBALDH1A1RAB9ACYP2C19LMNA | |
| SCHEMBL19701309 | 0.66 | LMNA (0.59) | SIGMAR1POLBGAAALDH1A1RAB9A | |
| SCHEMBL21489943 | 0.66 | LMNA (0.59) | SIGMAR1POLBGAAALDH1A1RAB9A | |
| SCHEMBL8234154 | 0.66 | HTT (0.54) | POLBGAAALDH1A1TDP1CYP3A4 |
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-2020038460-A1 | NOVEL QUINOLINE DERIVATIVE INHIBITOR | 南京药捷安康生物科技有限公司 | 2020-02-27 | — | — | WO | disclosed |