Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
| ▸ | KCNQ3 | O43525 | 5/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 5/20 | 0.38 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21504218 | 0.80 | IDO1 (0.51) | IDO1NPC1RAB9A | |
| SCHEMBL21496341 | 0.79 | IDO1 (0.53) | IDO1TAS1R3TAS1R1TAS1R2CES2 | |
| SCHEMBL24118369 | 0.77 | IDO1 (0.46) | IDO1TAS1R3TAS1R1TAS1R2CES2 | |
| SCHEMBL29460313 | 0.76 | IDO1 (0.52) | IDO1TAS1R3TAS1R1TAS1R2CES2 | |
| SCHEMBL21504281 | 0.74 | TAS1R3 (0.49) | TAS1R3TAS1R1TAS1R2CES2CES1 | |
| SCHEMBL19556221 | 0.67 | ATF4 (0.65) | — | |
| SCHEMBL29717191 | 0.67 | CES2 (0.59) | TAS1R3TAS1R1TAS1R2CES2CES1 | |
| SCHEMBL1128282 | 0.67 | CES2 (0.59) | TAS1R3TAS1R1TAS1R2CES2CES1 | |
| SCHEMBL31079848 | 0.67 | CES2 (0.46) | IDO1TAS1R3TAS1R1TAS1R2CES2 | |
| SCHEMBL21504283 | 0.67 | TAS1R3 (0.49) | IDO1TAS1R3TAS1R1TAS1R2CES2 |
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-20210393600-A1 | Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors | MERCK SHARP & DOHME CORP. (US) | 2021-12-23 | — | — | 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-20210393600-A1 | Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors | IDO1, IDO2, TPH1 | IDO1 1/4885TAS1R3 4634/4885TAS1R1 4287/4885 |
“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.