Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.33 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | FBP1 | P09467 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL24277825 | 0.77 | — | — | |
| SCHEMBL24376402 | 0.75 | — | — | |
| SCHEMBL19868864 | 0.73 | — | — | |
| SCHEMBL18509817 | 0.73 | — | — | |
| SCHEMBL27861546 | 0.72 | ABCB11 (0.35) | PHGDHPLIN1GMNNTRPA1ABCB11 | |
| Hydrochloric Acid SCHEMBL22575501 | 0.70 | EHMT2 (0.33) | PHGDHPLIN1GMNNTRPA1ABCB11 | |
| Hydrochloric Acid SCHEMBL22771718 | 0.70 | EHMT2 (0.33) | PHGDHPLIN1GMNNTRPA1ABCB11 | |
| SCHEMBL21993691 | 0.70 | — | — | |
| SCHEMBL12411260 | 0.69 | EHMT2 (0.32) | PHGDHPLIN1GMNNTRPA1ABCB11 | |
| SCHEMBL19868863 | 0.67 | — | — |
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-102286130-A | Conjugated diene polymer, conjugated diene polymer composition, and method for producing conjugated diene polymer | — | 2011-12-21 | — | — | CN | disclosed |