Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28049466 | 0.86 | ACP3 (0.46) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL28049476 | 0.77 | PNMT (0.43) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL28049473 | 0.76 | PNMT (0.42) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL27689629 | 0.69 | ACP3 (0.46) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL11217606 | 0.69 | NFE2L2 (0.34) | LMNAMAPTMEN1KMT2AKCNH2 | |
| SCHEMBL20762538 | 0.68 | ACP3 (0.57) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL20350341 | 0.68 | HTR2A (0.50) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL7533204 | 0.68 | PNMT (0.49) | ACP3HTR2AHTR2BHTR2CPNMT | |
| SCHEMBL27516633 | 0.67 | CNR2 (0.38) | SLC6A9IDO1TDO2 | |
| SCHEMBL19593126 | 0.67 | PNMT (0.54) | ACP3HTR2AHTR2BHTR2CPNMT |
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-102369188-B | As the replacement niacinamide of KCNQ2/3 conditioning agent | GRUNENTHAL GMBH (DE) | 2016-03-02 | — | — | CN | claimed |
| CN-102369188-B | As the replacement niacinamide of KCNQ2/3 conditioning agent | GRUNENTHAL GMBH (DE) | 2016-03-02 | — | — | CN | disclosed |