Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL751482 | 1.00 | MEN1 (0.36) | MEN1KMT2ATSHRTP53TDP1 | |
| SCHEMBL731152 | 0.81 | MEN1 (0.34) | MEN1KMT2ATSHRTP53TDP1 | |
| SCHEMBL749115 | 0.81 | MEN1 (0.34) | MEN1KMT2ATSHRTP53TDP1 | |
| SCHEMBL3513000 | 0.74 | GRM4 (0.37) | TSHR | |
| SCHEMBL1167081 | 0.73 | MEN1 (0.33) | MEN1KMT2ATSHR | |
| SCHEMBL8272949 | 0.73 | MEN1 (0.33) | MEN1KMT2ATSHR | |
| SCHEMBL730999 | 0.73 | MEN1 (0.33) | MEN1KMT2ATSHR | |
| SCHEMBL749109 | 0.73 | MEN1 (0.33) | MEN1KMT2ATSHR | |
| SCHEMBL751484 | 0.72 | GRM4 (0.36) | — | |
| SCHEMBL731005 | 0.72 | GRM4 (0.36) | — |
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-8138164-B2 | HCV NS3 protease inhibitors | MERCK SHARP & DOHME CORP. (US) | 2012-03-20 | — | — | US | disclosed |