Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | THPO | P40225 | 1/20 | 0.56 |
| ▸ | MTOR | P42345 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CETP | P11597 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | UBE2N | P61088 | 1/20 | 0.56 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | LAP3 | P28838 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL26641779 | 0.91 | CYP2D6 (0.63) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL16385618 | 0.87 | CYP2D6 (0.55) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL15948713 | 0.86 | CYP2D6 (0.53) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL27544781 | 0.84 | HTT (0.53) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL16367625 | 0.82 | CYP2D6 (0.62) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL10032011 | 0.82 | CYP2D6 (0.62) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL19441017 | 0.82 | CYP2D6 (0.62) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL3798897 | 0.82 | CYP2D6 (0.61) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL27960769 | 0.82 | MAPT (0.49) | CYP2D6SPHK1GMNNLMNAPOLB | |
| SCHEMBL18955122 | 0.82 | MAPT (0.49) | CYP2D6SPHK1GMNNLMNAPOLB |
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-110179736-A | A kind of imitative vernix compositions and the preparation method and application thereof | 湖南省锘恩科德生物科技有限公司 | 2019-08-30 | — | — | CN | disclosed |
| CN-108885205-A | METHOD FOR EVALUATING SKIN HEALTH | 花王株式会社 | 2018-11-23 | — | — | CN | disclosed |