Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.86 |
| ▸ | PHGDH | O43175 | 1/20 | 0.73 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.62 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.62 |
| ▸ | MLYCD | O95822 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL10720943 | 0.94 | PHGDH (0.81) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL27045664 | 0.93 | HPGD (1.00) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL4696938 | 0.86 | HPGD (0.72) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL2199279 | 0.86 | PHGDH (0.71) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL967889 | 0.85 | HPGD (0.70) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL5208543 | 0.85 | EPHX2 (0.77) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL103440 | 0.85 | PHGDH (0.69) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL2999369 | 0.85 | PHGDH (0.69) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| (4-Chlorophenyl)(Morpholino)Methanone SCHEMBL6937394 | 0.85 | PHGDH (1.00) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL5133157 | 0.85 | PHGDH (0.69) | HPGDPHGDHAKR1C3TSHRSMN1; SMN2 |
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-109890821-A | Amino-pyrrolopyrimidine ketone compound and its application method | 艾科尔公司 | 2019-06-14 | — | — | CN | disclosed |