Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| 1,4-Dichlorobenzene SCHEMBL27933757 | 0.85 | LMNA (0.50) | KDM4ETHRBTDP1KMT2AP2RX7 | |
| Ether SCHEMBL6687627 | 0.85 | CYP2A6 (0.50) | KMT2ANPC1HPGDRAB9AGAA | |
| SCHEMBL231632 | 0.80 | — | — | |
| Ether SCHEMBL391384 | 0.78 | ALDH1A1 (0.48) | KDM4EKMT2ANPC1HPGDRAB9A | |
| 1,4-Dichlorobenzene SCHEMBL10839178 | 0.77 | CYP2A6 (0.61) | DRD4TDP1KMT2ANPC1RAB9A | |
| SCHEMBL197605 | 0.77 | — | — | |
| Ether SCHEMBL28180268 | 0.76 | CES2 (0.46) | DRD4KDM4ETHRBTDP1KMT2A | |
| Ether SCHEMBL8472514 | 0.76 | ALDH1A1 (0.65) | DRD4TDP1KMT2ANPC1HPGD | |
| Bromobenzene SCHEMBL5103436 | 0.76 | ALDH1A1 (0.55) | TDP1KMT2ANPC1HPGDRAB9A | |
| Methyl Alcohol SCHEMBL27601464 | 0.75 | CYP2A6 (0.50) | DRD4KMT2ALMNAHTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3539968-B1 | NOVEL TRITYL PROTECTING AGENT | SEKISUI MEDICAL CO LTD (JP) | 2021-07-14 | — | — | EP | disclosed |