Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | HTR6 | P50406 | 4/20 | 0.38 |
| ▸ | OXTR | P30559 | 1/20 | 0.37 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30427210 | 0.88 | MEN1 (0.39) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL30456445 | 0.87 | AVPR2 (0.41) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL29719608 | 0.81 | MEN1 (0.49) | MEN1KMT2APOLBHTR6HTR2A | |
| SCHEMBL28996379 | 0.80 | ERN1 (0.41) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL30287363 | 0.80 | ERN1 (0.41) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL28997127 | 0.79 | MEN1 (0.36) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL30287349 | 0.79 | MEN1 (0.36) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL30287336 | 0.78 | KMT2A (0.38) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL28996384 | 0.78 | KMT2A (0.38) | MEN1KMT2APABPC1PTGS1PTGS2 | |
| SCHEMBL26650833 | 0.78 | MEN1 (0.37) | MEN1KMT2APABPC1PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023090942-A1 | PYRROLE DERIVATIVE OR PHARMACEUTICALLY OR SITOLOGICALLY ACCEPTABLE SALT THEREOF, AND COMPOSITION FOR PREVENTION, AMELIORATION OR TREATMENT OF GASTROINTESTINAL DISORDERS COMPRISING SAME AS ACTIVE INGREDIENT | 하나제약 주식회사 | 2023-05-25 | — | — | WO | disclosed |