Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9701943 | 0.90 | KDM4E (0.38) | KMT2A | |
| SCHEMBL9742716 | 0.88 | TPH1 (0.33) | — | |
| SCHEMBL9700725 | 0.88 | CYP1A2 (0.43) | CYP1A2CYP2C9HIF1A | |
| SCHEMBL9701731 | 0.80 | LTA4H (0.38) | — | |
| SCHEMBL9163760 | 0.79 | TSHR (0.42) | MEN1NPC1KMT2A | |
| SCHEMBL9700741 | 0.79 | MIF (0.42) | CYP1A2CYP2C9HIF1AMEN1NPC1 | |
| SCHEMBL9742575 | 0.76 | — | — | |
| SCHEMBL9700956 | 0.72 | TSHR (0.37) | MEN1NPC1KMT2A | |
| SCHEMBL1429155 | 0.70 | — | — | |
| SCHEMBL9005982 | 0.70 | KDM4E (0.46) | MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992014740-A1 | QUINOXALINE PHOSPHONO-AMINO ACIDS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-09-03 | — | — | WO | disclosed |
| US-5118675-A | Therapy for central nervous system disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-06-02 | — | — | US | disclosed |