Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24733682 | 0.91 | CYP3A4 (0.50) | ALOX15CA2CA1CA12CA7 | |
| SCHEMBL836498 | 0.90 | CA2 (0.40) | ALOX15CA2CA1CA12CA7 | |
| Iodide SCHEMBL872505 | 0.90 | CYP3A4 (0.49) | ALOX15CA2CA1CA12CA7 | |
| SCHEMBL8942996 | 0.84 | PRSS1 (0.50) | ALOX15CA2LMNATSHRCYP3A4 | |
| SCHEMBL224633 | 0.81 | ALOX15 (0.52) | ALOX15CA2LMNAHSD17B10TSHR | |
| SCHEMBL10581132 | 0.81 | CYP3A4 (0.49) | ALOX15CA2CA1LMNAHSD17B10 | |
| SCHEMBL224692 | 0.80 | ALOX15 (0.46) | ALOX15CA2CA1LMNAHSD17B10 | |
| SCHEMBL6671734 | 0.80 | ALOX15 (0.46) | ALOX15CA2CA1LMNAHSD17B10 | |
| SCHEMBL467542 | 0.79 | CYP3A4 (0.66) | CA2CA1LMNAHSD17B10TSHR | |
| SCHEMBL10262639 | 0.79 | ALDH1A1 (0.46) | CA2CA1CA12CA7CA14 |
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-113840591-A | Oil-in-water macroemulsion | 西姆莱斯股份公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-102197023-B | Compounds for the treatment of ophthalmic diseases and disorders | ACUCELA INC. (US) | 2015-12-16 | — | — | CN | disclosed |