Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23039631 | 1.00 | NCF1 (0.51) | NCF1HTTRECQLCCR5ALDH1A1 | |
| SCHEMBL22711397 | 0.88 | CCR5 (0.57) | HTTCCR5ALDH1A1HPGDMAPT | |
| SCHEMBL22711363 | 0.83 | NCF1 (0.48) | NCF1HTTRECQLCCR5ALDH1A1 | |
| SCHEMBL30697133 | 0.83 | NCF1 (0.48) | NCF1HTTRECQLCCR5ALDH1A1 | |
| SCHEMBL22711401 | 0.81 | CYP2A13 (0.56) | HTTRECQLCCR5ALDH1A1KDM4E | |
| SCHEMBL30697124 | 0.81 | CYP2A13 (0.56) | HTTRECQLCCR5ALDH1A1KDM4E | |
| SCHEMBL22711458 | 0.79 | HTT (0.45) | NCF1HTTRECQLALDH1A1KDM4E | |
| SCHEMBL30696977 | 0.79 | HTT (0.45) | NCF1HTTRECQLALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL22711527 | 0.77 | KMT2A (0.48) | HTTCCR5ALDH1A1KDM4EMAPT | |
| SCHEMBL15309988 | 0.77 | NPC1 (0.56) | NCF1HTTRECQLALDH1A1KDM4E |
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-111655685-B | Thiophene derivative and use thereof | 藤本株式会社 | 2023-11-17 | — | — | CN | disclosed |