Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | RAF1 | P04049 | 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 | |
|---|---|---|---|---|
| SCHEMBL3859555 | 0.82 | CD44 (0.38) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL10332219 | 0.82 | TSHR (0.40) | ALDH1A1L3MBTL1TSHRTRPA1LMNA | |
| SCHEMBL28847192 | 0.79 | MAP2K1 (0.40) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL1888537 | 0.77 | CYP3A4 (0.38) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| Hydrochloric Acid SCHEMBL27897741 | 0.76 | CYP3A4 (0.38) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL28415287 | 0.74 | MAP2K1 (0.44) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL622659 | 0.73 | ALDH1A1 (0.38) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL2582842 | 0.73 | CYP3A4 (0.33) | CYP3A4SMN1; SMN2ALOX15CASP1CASP7 | |
| SCHEMBL8660409 | 0.71 | ALDH1A1 (0.49) | CYP3A4ALDH1A1L3MBTL1CYP2C9CYP2C19 | |
| SCHEMBL13773379 | 0.71 | GABRA1 (0.44) | CYP3A4ALDH1A1L3MBTL1CYP1A2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3172272-B1 | MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION | MILLIKEN & CO (US) | 2020-11-25 | — | — | EP | disclosed |