Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | C1S | P09871 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | FLT1 | P17948 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29760319 | 0.94 | PARP1 (0.63) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL168961 | 0.94 | PARP1 (0.63) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL21815759 | 0.86 | PARP1 (0.55) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL8704652 | 0.83 | CES2 (0.55) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL6390040 | 0.80 | ALDH1A1 (0.57) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| 1,2-Dichloroethane SCHEMBL27913129 | 0.78 | PARP1 (0.55) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL27510 | 0.78 | ALDH1A1 (0.59) | PARP1ALDH1A1L3MBTL1TSHR | |
| SCHEMBL3357671 | 0.77 | PARP1 (0.53) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL241785 | 0.76 | PARP1 (0.68) | PARP1ALDH1A1L3MBTL1TP53HPGD | |
| SCHEMBL30153175 | 0.76 | PARP1 (0.68) | PARP1ALDH1A1L3MBTL1TP53HPGD |
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-104903293-B | Novel anti-invasive compounds | ABIVAX公司 | 2016-08-24 | — | — | CN | disclosed |