Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | THPO | P40225 | 1/20 | 0.50 |
| ▸ | MTOR | P42345 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CETP | P11597 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | UBE2N | P61088 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17253504 | 0.97 | SPHK1 (0.64) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL3652503 | 0.92 | SPHK1 (0.58) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL27795686 | 0.90 | SPHK1 (0.61) | SPHK1LMNACYP2D6TP53GMNN | |
| Isopropyl Alcohol SCHEMBL1766086 | 0.89 | SPHK1 (0.52) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL1295728 | 0.89 | SPHK1 (0.64) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL22805047 | 0.86 | SPHK1 (0.68) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL22804794 | 0.86 | SPHK1 (0.68) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL22804828 | 0.86 | SPHK1 (0.68) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL22805017 | 0.86 | SPHK1 (0.68) | SPHK1LMNACYP2D6TP53GMNN | |
| SCHEMBL22804810 | 0.86 | SPHK1 (0.68) | SPHK1LMNACYP2D6TP53GMNN |
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-113045385-B | Method for synthesizing aliphatic pinacol | 广东工业大学 | 2022-08-02 | — | — | CN | disclosed |
| CN-113045385-A | Method for synthesizing aliphatic pinacol | 广东工业大学 | 2021-06-29 | — | — | CN | disclosed |