Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CXCR2 | P25025 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.42 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.42 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20508280 | 0.84 | EPHX2 (0.47) | GAASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL15416384 | 0.83 | GAA (0.64) | GAASMN1; SMN2MAPK1MEN1KMT2A | |
| SCHEMBL14881305 | 0.80 | GAA (0.39) | GAAMEN1KMT2AALDH1A1CA2 | |
| SCHEMBL31646171 | 0.80 | MEN1 (0.56) | SMN1; SMN2MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL2129706 | 0.79 | ALDH1A1 (0.43) | GAASMN1; SMN2MEN1KMT2ACXCR2 | |
| SCHEMBL25274581 | 0.79 | MET (0.47) | CXCR2 | |
| SCHEMBL16045701 | 0.79 | F11 (0.40) | MAPK1CXCR2ALDH1A1CA1CA2 | |
| SCHEMBL20972012 | 0.78 | IDO1 (0.50) | CXCR2HDAC1 | |
| SCHEMBL5918956 | 0.75 | HDAC1 (0.41) | SMN1; SMN2MEN1KMT2ACXCR2ALDH1A1 | |
| SCHEMBL3726907 | 0.75 | CXCR2 (0.41) | SMN1; SMN2KMT2ACXCR2ALDH1A1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110218182-B | IDO inhibitors | 南京亘泰医药技术有限公司 | 2021-01-26 | — | — | CN | disclosed |