Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29042384 | 0.74 | AHR (0.42) | MAPTGAARAB9ASLC6A2SLC6A4 | |
| SCHEMBL4833473 | 0.71 | ROCK2 (0.52) | NOS1ROCK2MAPTROCK1METAP2 | |
| SCHEMBL16655618 | 0.71 | ALDH1A1 (0.38) | MAPTKDM4EMEN1ALDH1A1GAA | |
| SCHEMBL17863581 | 0.69 | MAPK1 (0.37) | MEN1RAB9AKMT2A | |
| SCHEMBL29042371 | 0.68 | MEN1 (0.42) | KDM4EMEN1ALDH1A1HPGDKMT2A | |
| SCHEMBL12838085 | 0.67 | ROCK2 (0.55) | NOS1ROCK2MAPTROCK1METAP2 | |
| SCHEMBL30886948 | 0.67 | SLC6A2 (0.41) | NOS1ROCK2MAPTROCK1METAP2 | |
| SCHEMBL1583361 | 0.67 | MET (0.80) | NOS1ROCK2MAPTROCK1METAP2 | |
| SCHEMBL9917339 | 0.67 | SLC6A2 (0.55) | NOS1ROCK2ROCK1METAP2CSNK2A1 | |
| SCHEMBL15554029 | 0.67 | TLR9 (0.50) | NOS1ROCK2MAPTROCK1METAP2 |
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-115873007-A | Condensed tetracyclic derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2023-03-31 | — | — | CN | disclosed |