Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR2E1 | Q9Y466 | 13/20 | 0.51 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.39 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.39 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.39 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL12372948 | 0.89 | NR2E1 (0.58) | NR2E1CYP2E1CYP2A6NTRK1DDR1 | |
| SCHEMBL15315567 | 0.84 | NR2E1 (0.54) | NR2E1CYP2E1CYP2A6NTRK1DDR1 | |
| SCHEMBL9609575 | 0.81 | NR2E1 (0.71) | NR2E1 | |
| SCHEMBL29186581 | 0.78 | MAOA (0.47) | NR2E1CYP2E1CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL30050455 | 0.78 | MAOA (0.47) | NR2E1CYP2E1CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL10183719 | 0.76 | CYP2E1 (0.51) | NR2E1CYP2E1CYP2A6NTRK1DDR1 | |
| SCHEMBL22604349 | 0.76 | CYP2E1 (0.51) | NR2E1CYP2E1CYP2A6OPRD1CYP1A2 | |
| SCHEMBL270618 | 0.75 | CYP1A2 (0.53) | NR2E1CYP2E1CYP2A6PTK2CYP1A2 | |
| SCHEMBL29556509 | 0.73 | CYP11B1 (0.50) | GABRA1GABRB2CYP2A6CYP3A4CYP19A1 | |
| SCHEMBL18289106 | 0.73 | CYP11B1 (0.50) | GABRA1GABRB2CYP2A6CYP3A4CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20200123165-A1 | KINASE INHIBITORS | INSILICO MEDICINE LTD. (CN) | 2020-04-23 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20200123165-A1 | KINASE INHIBITORS | DDR1, DDR2, DDRGK1 | NR2E1 579/4885GABRA1 2963/4885GABRB2 4095/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.