Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 3/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.45 |
| ▸ | PRKCG | P05129 | 2/20 | 0.45 |
| ▸ | PRKCB | P05771 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | PRKCA | P17252 | 2/20 | 0.45 |
| ▸ | PRKACA | P17612 | 2/20 | 0.45 |
| ▸ | PRKACG | P22612 | 2/20 | 0.45 |
| ▸ | PRKACB | P22694 | 2/20 | 0.45 |
| ▸ | PRKCH | P24723 | 2/20 | 0.45 |
| ▸ | PRKCI | P41743 | 2/20 | 0.45 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.45 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.45 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.45 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28210781 | 0.99 | RYR2 (0.49) | RYR2NAMPTCHRNB2CHRNA4PRKD3 | |
| SCHEMBL4710815 | 0.81 | HTR6 (0.51) | KMT2AHTR2BPOLB | |
| SCHEMBL28858447 | 0.76 | CHRNB4 (0.45) | RYR2CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL18553780 | 0.76 | HTR6 (0.64) | NAMPTCHRNB2CHRNA4CYP3A4KDM4E | |
| SCHEMBL17201780 | 0.75 | ALDH1A1 (0.55) | KDM4EMEN1KMT2AROCK1SMN1; SMN2 | |
| SCHEMBL30610304 | 0.74 | KDM4E (0.59) | NAMPTCHRNB2CHRNA4PRKD3PRKCG | |
| SCHEMBL29978636 | 0.73 | KMT2A (0.48) | CYP3A4CYP2C19MEN1KMT2ACYP2D6 | |
| SCHEMBL28211327 | 0.73 | ADRB3 (0.45) | RYR2KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL7141364 | 0.73 | CHRNB2 (0.47) | NAMPTCHRNB2CHRNA4CYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL28210785 | 0.72 | KMT2A (0.47) | CYP3A4CYP2C19MEN1KMT2AHTR1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107980040-A | 1,3,4- oxadiazoles sulfamide derivative as 6 inhibitor of histone deacetylase enzyme and the medical composition containing it | 株式会社钟根堂 | 2018-05-01 | — | — | CN | disclosed |