Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2885293 | 0.80 | MEN1 (0.35) | SLC6A4THRBMEN1KMT2A | |
| SCHEMBL19576382 | 0.76 | MEN1 (0.41) | THRBMEN1KMT2A | |
| SCHEMBL8259699 | 0.76 | MEN1 (0.41) | THRBMEN1KMT2A | |
| SCHEMBL22778734 | 0.73 | — | — | |
| SCHEMBL12262003 | 0.73 | — | — | |
| SCHEMBL17662580 | 0.73 | — | — | |
| SCHEMBL328247 | 0.73 | — | — | |
| SCHEMBL20031691 | 0.73 | — | — | |
| SCHEMBL14565351 | 0.72 | SLC6A4 (0.35) | SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL43635 | 0.72 | — | — |
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-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |