Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 6/20 | 0.67 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.67 |
| ▸ | NQO2 | P16083 | 5/20 | 0.53 |
| ▸ | ESR1 | P03372 | 4/20 | 0.53 |
| ▸ | TTR | P02766 | 3/20 | 0.53 |
| ▸ | AHR | P35869 | 3/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | ABL1 | P00519 | 2/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.53 |
| ▸ | BCR | P11274 | 2/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9605435 | 0.91 | CYP1A1 (0.58) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL18656029 | 0.86 | RELA (0.57) | CYP1A1CYP1B1CYP1A2NQO2CYP19A1 | |
| SCHEMBL19076183 | 0.85 | CYP1A2 (0.68) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL23743198 | 0.81 | CYP1A1 (0.51) | CYP1A1CYP1B1CYP1A2TUBB4ATUBB | |
| SCHEMBL23743201 | 0.81 | TUBB1 (0.60) | CYP1A1CYP1B1CYP1A2NQO2PTGS2 | |
| SCHEMBL7047647 | 0.80 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL7047642 | 0.80 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL28187760 | 0.77 | CYP1A1 (0.63) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL23743203 | 0.77 | CYP1A1 (0.57) | CYP1A1CYP1B1CYP1A2NQO2ESR1 | |
| SCHEMBL1743365 | 0.75 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2NQO2ESR1 |
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-20210246109-A1 | POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 | UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION | 2021-08-12 | — | — | 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-20210246109-A1 | POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 | CYP11B1, CYP1B1, CYP27A1 | CYP1A1 6/4885CYP1B1 2/4885CYP1A2 18/4885 |
“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.