Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9846223 | 0.82 | CYP2C19 (0.45) | CYP2C19CYP2C9ALDH1A1MAPTCA12 | |
| SCHEMBL9846332 | 0.74 | CYP2C19 (0.39) | CYP2C19CYP2C9ALDH1A1MAPTMEN1 | |
| SCHEMBL9846329 | 0.74 | CYP2C19 (0.39) | CYP2C19CYP2C9ALDH1A1MAPTMEN1 | |
| SCHEMBL9281450 | 0.73 | RAB9A (0.41) | MAPTKDM4ERAB9AGAAALOX15 | |
| SCHEMBL9170296 | 0.73 | KDM4E (0.44) | ALDH1A1MAPTKDM4EGAAPDE10A | |
| SCHEMBL27337641 | 0.70 | POLB (0.49) | HPGDALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL9278136 | 0.70 | MAPT (0.51) | ALDH1A1MAPTKDM4EKMT2AHSD17B10 | |
| SCHEMBL9283645 | 0.70 | MAPT (0.48) | ALDH1A1MAPTKDM4EHSD17B10GAA | |
| SCHEMBL9846230 | 0.70 | BTK (0.41) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL9168694 | 0.69 | PDE3B (0.42) | ALDH1A1MAPTKDM4EMEN1KMT2A |
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-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |