Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.47 |
| ▸ | MIF | P14174 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28909455 | 1.00 | RAB9A (0.47) | RAB9AMIFCTSSCTSKNPC1 | |
| SCHEMBL28909466 | 0.82 | ALDH1A1 (0.52) | RAB9AMIFCTSKNPC1SMN1; SMN2 | |
| SCHEMBL20582046 | 0.80 | MIF (0.48) | RAB9AMIFCTSSCTSKNPC1 | |
| SCHEMBL28909512 | 0.80 | MIF (0.48) | RAB9AMIFCTSSCTSKNPC1 | |
| SCHEMBL28909481 | 0.78 | CTSS (0.47) | RAB9AMIFCTSSCTSKNPC1 | |
| SCHEMBL4590703 | 0.76 | RIPK1 (0.60) | RAB9ACTSSCTSKMAPTKMT2A | |
| SCHEMBL27041579 | 0.76 | CTSS (0.43) | CTSSCTSKSMN1; SMN2MAPTKMT2A | |
| SCHEMBL14942145 | 0.75 | RAB9A (0.52) | RAB9AMIFCTSSCTSKNPC1 | |
| SCHEMBL6232571 | 0.73 | RIPK1 (0.50) | RAB9ACTSSCTSKNPC1MAPT | |
| SCHEMBL23081599 | 0.73 | MAPT (0.54) | RAB9AMIFNPC1SMN1; SMN2RECQL |
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-115322151-A | Method for synthesizing chiral multi-stereocenter pyrazolidine compounds by copper catalysis | 河南师范大学 | 2022-11-11 | — | — | CN | disclosed |