Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 4/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28701866 | 0.78 | AOC3 (0.41) | AAK1IMPDH2IMPDH1 | |
| SCHEMBL16414084 | 0.78 | CSNK2A1 (0.49) | AAK1IMPDH2IMPDH1NOTUMMAP4K4 | |
| SCHEMBL16414061 | 0.75 | IMPDH2 (0.68) | AAK1IMPDH2IMPDH1 | |
| SCHEMBL2781028 | 0.73 | LMNA (0.58) | AAK1NOTUMMAP4K4PTK2GAA | |
| SCHEMBL27684292 | 0.72 | CYP2C9 (0.39) | LOXL2 | |
| SCHEMBL28710975 | 0.72 | IMPDH2 (0.47) | AAK1IMPDH2IMPDH1KDM4ENPC1 | |
| SCHEMBL28710979 | 0.72 | KEAP1 (0.41) | AAK1IMPDH2IMPDH1NOTUMCYP19A1 | |
| SCHEMBL29468019 | 0.71 | MAP4K4 (0.63) | AAK1NOTUMMAP4K4PTK2LOXL2 | |
| SCHEMBL38656167 | 0.71 | PDK2 (0.48) | AAK1IMPDH2IMPDH1NOTUMMAP4K4 | |
| SCHEMBL9955245 | 0.71 | PDK2 (0.48) | AAK1IMPDH2IMPDH1NOTUMMAP4K4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114206870-B | Tricyclic AKR1C 3-dependent KARS inhibitors | 诺华股份有限公司 | 2024-09-03 | — | — | CN | disclosed |
| CN-114206870-A | Tricyclic AKR1C3 dependent KARS inhibitors | 诺华股份有限公司 | 2022-03-18 | — | — | CN | disclosed |