Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GRK2 | P25098 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28339241 | 1.00 | PARP1 (0.37) | PARP1PARP10RAB9AMAPTLMNA | |
| SCHEMBL3313426 | 0.80 | SLC6A2 (0.36) | RAB9AKMT2ANPC1KDM4E | |
| SCHEMBL3313422 | 0.80 | SLC6A2 (0.36) | RAB9AKMT2ANPC1KDM4E | |
| SCHEMBL9913081 | 0.80 | SLC6A2 (0.36) | RAB9AKMT2ANPC1KDM4E | |
| SCHEMBL17174644 | 0.79 | CYP2C19 (0.46) | RAB9AMAPTLMNAGAAALDH1A1 | |
| SCHEMBL3312267 | 0.75 | MAPK1 (0.39) | ALDH1A1CYP2C19KDM4EHTTSMN1; SMN2 | |
| SCHEMBL1298778 | 0.72 | LMNA (0.38) | RAB9ALMNAALDH1A1L3MBTL1NPC1 | |
| SCHEMBL2060019 | 0.72 | LMNA (0.38) | PARP1MAPTLMNAALDH1A1L3MBTL1 | |
| SCHEMBL15956594 | 0.68 | LMNA (0.42) | RAB9AMAPTLMNAALDH1A1MEN1 | |
| SCHEMBL3311103 | 0.68 | LMNA (0.36) | RAB9ALMNACYP2C19MEN1KMT2A |
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-110627795-A | Phosphodiesterase inhibitors and uses thereof | 南京药捷安康生物科技有限公司 | 2019-12-31 | — | — | CN | disclosed |