Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.58 |
| ▸ | PGR | P06401 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | ACLY | P53396 | 1/20 | 0.53 |
| ▸ | CDC25A | P30304 | 1/20 | 0.52 |
| ▸ | CDC25B | P30305 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.50 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.50 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.50 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.50 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.50 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30737484 | 0.89 | PGR (0.71) | HTR6POLBCYP19A1PGRMEN1 | |
| SCHEMBL16431575 | 0.89 | PGR (0.71) | HTR6POLBCYP19A1PGRMEN1 | |
| SCHEMBL28271815 | 0.87 | HTR6 (0.79) | HTR6POLBCYP19A1MEN1KMT2A | |
| SCHEMBL30737524 | 0.87 | HTR6 (0.79) | HTR6POLBCYP19A1MEN1KMT2A | |
| SCHEMBL28509432 | 0.85 | HTR6 (0.75) | HTR6POLBCYP19A1MEN1KMT2A | |
| SCHEMBL28271796 | 0.83 | HTR6 (0.83) | HTR6POLBCYP19A1PGRKMT2A | |
| SCHEMBL28270292 | 0.82 | HTR6 (0.71) | HTR6POLBCYP19A1MEN1KMT2A | |
| SCHEMBL2723618 | 0.81 | HTR6 (1.00) | HTR6POLBPGRMEN1KMT2A | |
| SCHEMBL29118844 | 0.81 | PRMT1 (0.66) | PGRMEN1KMT2AACLYCYP3A4 | |
| SCHEMBL28271812 | 0.81 | HTR6 (1.00) | HTR6POLBCYP19A1KMT2APKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-109081793-B | Sulfonamide urease inhibitor and preparation method and application thereof | 吉首大学 | 2021-03-30 | — | — | CN | disclosed |
| CN-109096156-B | Disulfonyl meta-aryl diamine urease inhibitor and preparation method and application thereof | 吉首大学 | 2021-01-15 | — | — | CN | disclosed |