Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.52 |
| ▸ | BRD4 | O60885 | 2/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | APP | P05067 | 2/20 | 0.43 |
| ▸ | SNCA | P37840 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28001204 | 0.86 | KMT2A (0.56) | HTR6CYP11B2KMT2AALDH1A1ERBB2 | |
| SCHEMBL10412907 | 0.85 | HTR6 (0.58) | HTR6BRD4PTGDR2APPSNCA | |
| Quinoline SCHEMBL28046368 | 0.85 | HTR6 (0.52) | HTR6BRD4CYP11B2APPSNCA | |
| SCHEMBL28080468 | 0.83 | ALDH1A1 (0.44) | HTR6BRD4PTGDR2CYP11B2APP | |
| SCHEMBL6086002 | 0.77 | HTR2C (0.55) | HTR6BRD4PTGDR2APPSNCA | |
| SCHEMBL9584191 | 0.74 | APP (0.53) | HTR6PTGDR2APPSNCAHTR2C | |
| Quinoline SCHEMBL28192735 | 0.73 | ALDH1A1 (0.65) | KMT2AALDH1A1CYP3A4 | |
| SCHEMBL6087849 | 0.73 | MAPT (0.53) | HTR6BRD4PTGDR2KMT2AHTR2C | |
| SCHEMBL4716978 | 0.72 | CYP11B1 (0.62) | HTR6CYP11B2KMT2AALDH1A1TNF | |
| SCHEMBL31061608 | 0.72 | CYP11B1 (0.62) | HTR6CYP11B2KMT2AALDH1A1TNF |
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-105814019-A | Urea derivative or pharmacologically acceptable salt thereof | 杏林制药株式会社 | 2016-07-27 | — | — | CN | disclosed |