Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 0.60 |
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | STAT1 | P42224 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945487 | 0.80 | KDM4E (0.50) | NQO1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL8945493 | 0.79 | AKR1C3 (0.52) | NQO1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL9210274 | 0.78 | NQO1 (0.67) | NQO1VKORC1CYP2C9MAPTALDH1A1 | |
| SCHEMBL28510435 | 0.77 | NQO1 (0.82) | NQO1VKORC1CYP2C9MAPTALDH1A1 | |
| SCHEMBL8945550 | 0.77 | NQO1 (0.50) | NQO1VKORC1CYP2C9ALDH1A1LMNA | |
| SCHEMBL8945650 | 0.77 | CYP2C9 (0.50) | NQO1VKORC1CYP2C9ALDH1A1LMNA | |
| SCHEMBL8945575 | 0.77 | NQO1 (0.40) | NQO1VKORC1 | |
| SCHEMBL8945484 | 0.76 | NQO1 (0.40) | NQO1VKORC1 | |
| SCHEMBL8945445 | 0.75 | NQO1 (0.56) | NQO1VKORC1CYP2C9ALDH1A1LMNA | |
| SCHEMBL7354536 | 0.75 | CYP2C9 (0.69) | NQO1VKORC1CYP2C9MAPTALDH1A1 |
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-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |