Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | UBE2N | P61088 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL2184458 | 0.74 | CA1 (0.43) | CA1CA2KMT2AMEN1ALOX5 | |
| SCHEMBL1156364 | 0.74 | CYP2C9 (0.46) | CA1CA2KMT2AMEN1ALOX5 | |
| SCHEMBL30877445 | 0.74 | CYP2C9 (0.41) | CA1CA2KMT2AMEN1CA12 | |
| SCHEMBL22748758 | 0.73 | LMNA (0.37) | ALOX5LMNAKDM4ECYP2C9MMP2 | |
| SCHEMBL5427469 | 0.73 | MEN1 (0.49) | CA1CA2KMT2AMEN1CA9 | |
| SCHEMBL16053003 | 0.73 | MEN1 (0.52) | CA1CA2KMT2AMEN1CA12 | |
| SCHEMBL22748400 | 0.72 | KMT2A (0.49) | CA1CA2KMT2AMEN1CA12 | |
| SCHEMBL21807392 | 0.72 | FBP1 (0.53) | CA1CA2KMT2AMEN1CA12 | |
| SCHEMBL10125216 | 0.71 | POLB (0.45) | KMT2AMEN1ALOX5LMNAFBP1 | |
| SCHEMBL20111996 | 0.71 | PTPN11 (0.43) | CA1CA2FBP1CYP2C9TDP1 |
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-2020245297-A1 | PYRROLE DERIVATIVES AS ACC INHIBITORS | ALMIRALL, S.A. (ES) | 2020-12-10 | — | — | WO | disclosed |