Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMD14 | O00487 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL473919 | 0.72 | ALDH1A1 (0.51) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL29726958 | 0.72 | ALDH1A1 (0.51) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL25385523 | 0.71 | PSMD14 (0.43) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL28115058 | 0.71 | PSMD14 (0.43) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL3655489 | 0.70 | MAPK1 (0.47) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL17294344 | 0.70 | ATM (0.51) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL198706 | 0.70 | MAPK1 (0.47) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL2671241 | 0.70 | PSMD14 (0.44) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL31629408 | 0.69 | MAPK1 (0.46) | PSMD14MAPK1MAPTPOLBATM | |
| SCHEMBL31108808 | 0.69 | PDGFRB (0.48) | PSMD14MAPK1MAPTPOLBATM |
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-106117205-A | Pyrazolo spiral shell ketone derivatives as S-acetyl-coenzyme-A carboxylase inhibitor class | 辉瑞大药厂 | 2016-11-16 | — | — | CN | disclosed |