Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 6/20 | 0.71 |
| ▸ | PRKCI | P41743 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL78110 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL2674176 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1 | |
| Water SCHEMBL2854772 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL4781930 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1 | |
| Iodide SCHEMBL29834228 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1CYP1A2CYP3A4 | |
| Fluoride SCHEMBL31379738 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1CYP1A2CYP3A4 | |
| Bromide SCHEMBL28608395 | 0.98 | TBXAS1 (0.68) | TBXAS1PRKCICYP19A1CYP1A2CYP3A4 | |
| SCHEMBL139976 | 0.93 | TBXAS1 (0.75) | TBXAS1PRKCI | |
| SCHEMBL3173441 | 0.91 | TBXAS1 (0.79) | TBXAS1 | |
| SCHEMBL2369290 | 0.91 | TBXAS1 (0.79) | TBXAS1 |
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-5399705-A | 1,1'-bis(3-aminopropyl)-2,2'-diimidazole | BASF AKTIENGESELLSCHAFT (DE) | 1995-03-21 | — | — | US | claimed |