Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SCD | O00767 | 1/20 | 0.39 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL18317451 | 0.86 | TRPV1 (0.42) | TRPV1PDK4MAPTALDH1A1MEN1 | |
| SCHEMBL29915661 | 0.84 | PDK4 (0.61) | PDK4JAK1CNR1 | |
| SCHEMBL17223031 | 0.84 | PDK4 (0.61) | PDK4JAK1CNR1 | |
| SCHEMBL23064245 | 0.83 | ALDH1A1 (0.48) | PDK4MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL3325476 | 0.79 | MAPT (0.50) | TRPV1PDK4MAPTALDH1A1MEN1 | |
| SCHEMBL28426082 | 0.79 | TRPV1 (0.38) | TRPV1MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL28428615 | 0.78 | MAPT (0.42) | PDK4MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL28433071 | 0.75 | TRPV1 (0.45) | TRPV1MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL5371432 | 0.75 | CCNT1 (0.47) | PDK4MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL4949936 | 0.74 | PDK4 (0.44) | TRPV1PDK4MAPTALDH1A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111393434-B | Substituted 4-phenylpiperidines, their preparation and use | 哥伦比亚大学董事会 | 2022-11-04 | — | — | CN | disclosed |
| CN-111393434-A | Substituted 4-phenylpiperidines, their preparation and use | 哥伦比亚大学董事会 | 2020-07-10 | — | — | CN | disclosed |
| CN-106794364-B | Substituted 4-phenylpiperidines, their preparation and use | 哥伦比亚大学董事会 | 2019-12-24 | — | — | CN | disclosed |