Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 7/20 | 0.55 |
| ▸ | PRKCG | P05129 | 7/20 | 0.55 |
| ▸ | PRKCB | P05771 | 7/20 | 0.55 |
| ▸ | PRKCA | P17252 | 7/20 | 0.55 |
| ▸ | PRKCH | P24723 | 7/20 | 0.55 |
| ▸ | PRKCI | P41743 | 7/20 | 0.55 |
| ▸ | PRKCE | Q02156 | 7/20 | 0.55 |
| ▸ | PRKCQ | Q04759 | 7/20 | 0.55 |
| ▸ | PRKCZ | Q05513 | 7/20 | 0.55 |
| ▸ | PRKCD | Q05655 | 7/20 | 0.55 |
| ▸ | PRKD1 | Q15139 | 7/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.55 |
| ▸ | PRKACA | P17612 | 5/20 | 0.55 |
| ▸ | PRKACG | P22612 | 5/20 | 0.55 |
| ▸ | PRKACB | P22694 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL117745 | 0.98 | CYP3A4 (0.56) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL29696494 | 0.98 | CYP3A4 (0.56) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| Hydrochloric Acid SCHEMBL9477757 | 0.97 | LMNA (0.57) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| Sulfuric Acid SCHEMBL29120407 | 0.97 | CYP3A4 (0.55) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| Hydrochloric Acid SCHEMBL8670953 | 0.97 | LMNA (0.57) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL26422606 | 0.84 | TNF (0.46) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL6967362 | 0.84 | CYP3A4 (0.59) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| Hydrochloric Acid SCHEMBL27788261 | 0.83 | TNF (0.45) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| Hydrochloric Acid SCHEMBL28291160 | 0.81 | LMNA (0.49) | CYP3A4PRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL1551138 | 0.81 | CA1 (0.61) | CYP3A4PRKD3PRKCGPRKCBPRKCA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108912046-B | A kind of preparation method for treating ocular hypertension pharmaceutical intermediate | 王淑英 | 2019-09-24 | — | — | CN | claimed |
| CN-108912046-A | A kind of preparation method for treating ocular hypertension pharmaceutical intermediate | 王淑英 | 2018-11-30 | — | — | CN | claimed |
| CN-108912046-B | A kind of preparation method for treating ocular hypertension pharmaceutical intermediate | 王淑英 | 2019-09-24 | — | — | CN | disclosed |
| CN-108912046-A | A kind of preparation method for treating ocular hypertension pharmaceutical intermediate | 王淑英 | 2018-11-30 | — | — | CN | disclosed |