Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL7985352 | 1.00 | TLR9 (0.46) | TLR9ALDH1A1TDP1CYP2C9LMNA | |
| SCHEMBL7988245 | 0.87 | ALDH1A1 (0.47) | TLR9ALDH1A1TDP1CYP2C9RECQL | |
| SCHEMBL7988239 | 0.87 | ALDH1A1 (0.47) | TLR9ALDH1A1TDP1CYP2C9RECQL | |
| SCHEMBL6349926 | 0.84 | APEX1 (0.46) | TLR9ALDH1A1TDP1CYP2C9LMNA | |
| SCHEMBL7984321 | 0.84 | HTT (0.49) | NPSR1AKR1C3KMT2AMEN1KEAP1 | |
| SCHEMBL7984313 | 0.84 | HTT (0.49) | NPSR1AKR1C3KMT2AMEN1KEAP1 | |
| SCHEMBL6349930 | 0.84 | APEX1 (0.46) | TLR9ALDH1A1TDP1CYP2C9LMNA | |
| SCHEMBL7991531 | 0.79 | KMT2A (0.43) | ALDH1A1LMNARECQLNPSR1KMT2A | |
| SCHEMBL7991528 | 0.79 | KMT2A (0.43) | ALDH1A1LMNARECQLNPSR1KMT2A | |
| SCHEMBL7991252 | 0.76 | KMT2A (0.39) | ALDH1A1LMNARECQLNPSR1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6274758-B1 | ENANTIOMORPH SELECTIVITY | DARWIN DISCOVERY, LTD. (GB) | 2001-08-14 | — | — | US | disclosed |