Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.60 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.48 |
| ▸ | HTR3B | O95264 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.48 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 7/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15542432 | 0.95 | ADRB1 (0.67) | SMN1; SMN2ADRB1SIRT6ALDH1A1HTR3E | |
| Hydrochloric Acid SCHEMBL20568855 | 0.93 | ADRB1 (0.65) | SMN1; SMN2ADRB1SIRT6ALDH1A1HTR3E | |
| SCHEMBL6562147 | 0.80 | ADRB1 (0.69) | SMN1; SMN2ADRB1SIRT6ALDH1A1HTR3E | |
| SCHEMBL20567878 | 0.80 | LMNA (0.59) | SMN1; SMN2SIRT6ALDH1A1MAPTMET | |
| SCHEMBL15542558 | 0.79 | SLC6A9 (0.52) | SMN1; SMN2ADRB1ALDH1A1MAPTMET | |
| SCHEMBL15542522 | 0.79 | CYP2C9 (0.46) | SMN1; SMN2ADRB1ALDH1A1MAPTMEN1 | |
| SCHEMBL2972930 | 0.79 | SIRT6 (0.55) | ADRB1SIRT6ALDH1A1MAPTMET | |
| SCHEMBL15553691 | 0.79 | MAPT (0.55) | SMN1; SMN2ADRB1ALDH1A1MAPTTHRB | |
| SCHEMBL20568475 | 0.77 | ADRB1 (0.42) | SMN1; SMN2ADRB1MAPTMEN1KMT2A | |
| SCHEMBL16895216 | 0.77 | ADRB1 (0.42) | SMN1; SMN2ADRB1SIRT6ALDH1A1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112601752-A | Novel inhibitors of MAP4K1 | 伊克诺斯科学公司 | 2021-04-02 | — | — | CN | disclosed |
| EP-3630778-A1 | NOVEL INHIBITORS OF MAP4K1 | Ichnos Sciences SA (CH) | 2020-04-08 | — | — | EP | disclosed |
| WO-2018215668-A1 | NOVEL INHIBITORS OF MAP4K1 | GLENMARK PHARMACEUTICALS S.A. (CH) | 2018-11-29 | — | — | WO | disclosed |