Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL992196 | 0.82 | NPC1 (0.33) | NPC1PKMRAB9AADRB2ADRB1 | |
| SCHEMBL30048057 | 0.81 | EPHX1 (0.44) | — | |
| SCHEMBL27260466 | 0.79 | KDM4E (0.39) | NPC1PKMRAB9AADRB2ADRB1 | |
| SCHEMBL27795768 | 0.79 | ACHE (0.33) | — | |
| SCHEMBL6978891 | 0.74 | NPC1 (0.38) | NPC1PKMRAB9AADRB2ADRB1 | |
| SCHEMBL16889106 | 0.74 | KDM4E (0.37) | — | |
| SCHEMBL2187338 | 0.71 | NPC1 (0.36) | NPC1PKMRAB9AMEN1KMT2A | |
| SCHEMBL6097662 | 0.70 | MEN1 (0.55) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28313907 | 0.68 | EPHX1 (0.37) | — | |
| SCHEMBL92208 | 0.68 | — | — |
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-4066440-A | SYMMETRICAL ALKYNYL UREAS | PPG INDUSTRIES, INC. (US) | 1978-01-03 | — | — | US | disclosed |