Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 11/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Urea SCHEMBL10578369 | 0.85 | AKR1B1 (0.43) | AKR1B1TDP1NTRK1 | |
| SCHEMBL9818841 | 0.78 | POLB (0.42) | AKR1B1TDP1MAOB | |
| SCHEMBL9818844 | 0.78 | POLB (0.42) | AKR1B1TDP1MAOB | |
| SCHEMBL5162275 | 0.76 | AKR1B1 (0.44) | AKR1B1TDP1 | |
| SCHEMBL27280860 | 0.75 | AKR1B1 (0.39) | AKR1B1CYP19A1MAOB | |
| SCHEMBL9432299 | 0.73 | SLC6A3 (0.41) | AKR1B1NTRK1 | |
| SCHEMBL1569617 | 0.73 | KDM4C (0.46) | — | |
| SCHEMBL1569902 | 0.72 | CFTR (0.47) | AKR1B1 | |
| SCHEMBL5161934 | 0.71 | CHRNB2 (0.40) | TDP1 | |
| SCHEMBL31110943 | 0.69 | PARP1 (0.36) | AKR1B1TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530198-A1 | HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS | PFIZER INC. (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1991015491-A1 | HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS | PFIZER INC. (US) | 1991-10-17 | — | — | WO | disclosed |