Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 6/20 | 0.42 |
| ▸ | PRKCG | P05129 | 6/20 | 0.42 |
| ▸ | PRKCB | P05771 | 6/20 | 0.42 |
| ▸ | PRKCA | P17252 | 6/20 | 0.42 |
| ▸ | PRKCH | P24723 | 6/20 | 0.42 |
| ▸ | PRKCI | P41743 | 6/20 | 0.42 |
| ▸ | PRKCE | Q02156 | 6/20 | 0.42 |
| ▸ | PRKCQ | Q04759 | 6/20 | 0.42 |
| ▸ | PRKCZ | Q05513 | 6/20 | 0.42 |
| ▸ | PRKCD | Q05655 | 6/20 | 0.42 |
| ▸ | PRKD1 | Q15139 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 4/20 | 0.40 |
| ▸ | PRKACG | P22612 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28399717 | 0.87 | PRKD3 (0.55) | PRKD3PRKCGPRKCBPRKCAPRKCH | |
| SCHEMBL28394910 | 0.83 | PRKD3 (0.42) | TNFPRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL11983469 | 0.81 | TNF (0.46) | TNFPRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL29732947 | 0.79 | CA1 (0.57) | MEN1KMT2ACA1CA2CA9 | |
| SCHEMBL29093707 | 0.79 | CA1 (0.57) | MEN1KMT2ACA1CA2CA9 | |
| SCHEMBL1002263 | 0.79 | CA1 (0.57) | MEN1KMT2ACA1CA2CA9 | |
| SCHEMBL3129943 | 0.78 | TNF (0.46) | TNFPRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL30002842 | 0.78 | TNF (0.46) | TNFPRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL18019196 | 0.78 | CA2 (0.61) | TNFPRKD3PRKCGPRKCBPRKCA | |
| SCHEMBL26422606 | 0.78 | TNF (0.46) | TNFPRKD3PRKCGPRKCBPRKCA |
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-111153856-A | Preparation method of fasudil hydrochloride impurity with genotoxicity | 湖南增达生物科技有限公司 | 2020-05-15 | — | — | CN | claimed |
| CN-111153856-A | Preparation method of fasudil hydrochloride impurity with genotoxicity | 湖南增达生物科技有限公司 | 2020-05-15 | — | — | CN | disclosed |