Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 4/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30109415 | 0.90 | SLC6A4 (0.45) | HDAC8KDM4EALDH1A1CYP3A4MAPT | |
| SCHEMBL20168529 | 0.83 | TRPV1 (0.47) | SPRTRPV1PTGS2FAAHKDM4E | |
| SCHEMBL20182251 | 0.83 | TRPV1 (0.47) | SPRTRPV1PTGS2FAAHKDM4E | |
| SCHEMBL20168527 | 0.83 | TRPV1 (0.47) | SPRTRPV1PTGS2FAAHKDM4E | |
| SCHEMBL20168641 | 0.74 | SLC6A4 (0.53) | CA12CA1CA2CA9CAPN1 | |
| SCHEMBL20168642 | 0.74 | SLC6A4 (0.53) | CA12CA1CA2CA9CAPN1 | |
| Melatonin SCHEMBL3998646 | 0.69 | MTNR1A (0.58) | FAAHKDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL20168582 | 0.69 | HDAC8 (0.77) | SPRHDAC8TRPV1PTGS2FAAH | |
| SCHEMBL29804259 | 0.69 | HDAC8 (0.77) | SPRHDAC8TRPV1PTGS2FAAH | |
| SCHEMBL20168578 | 0.69 | HDAC8 (0.77) | SPRHDAC8TRPV1PTGS2FAAH |
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-110177581-B | Myeloperoxidase imaging agents | 通用医疗公司 | 2023-01-03 | — | — | CN | disclosed |