Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BCL9 | O00512 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23410201 | 0.88 | ADRB1 (0.45) | ALDH1A1KDM4EMAPTTDP1KCNJ1 | |
| SCHEMBL20474622 | 0.78 | HSPB1 (0.47) | ALDH1A1KCNJ1GAASMN1; SMN2RAB9A | |
| SCHEMBL29799396 | 0.78 | KMT2A (0.41) | ALDH1A1KDM4EMAPTKCNJ1GAA | |
| SCHEMBL17861567 | 0.73 | THRB (0.46) | ALDH1A1MAPTGAASMN1; SMN2BCL9 | |
| Oxalic Acid SCHEMBL11225817 | 0.72 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTTDP1SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL31064275 | 0.72 | GAA (0.53) | ALDH1A1MAPTTDP1KCNJ1GAA | |
| SCHEMBL10514596 | 0.71 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTTDP1SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL4435632 | 0.70 | PKM (0.38) | KDM4EKMT2A | |
| SCHEMBL21607088 | 0.70 | SLC6A2 (0.37) | — | |
| SCHEMBL17848479 | 0.70 | OPRM1 (0.45) | — |
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-115210225-A | Substituted aminoquinolones as immuno-activated DGKALPHA inhibitors | 拜耳公司 | 2022-10-18 | — | — | CN | disclosed |