Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.53 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11725835 | 0.89 | S100A4 (0.56) | S100A4PDK2MAPTALDH1A1NPC1 | |
| SCHEMBL11308153 | 0.86 | S100A4 (0.56) | S100A4PDK2MAPTALDH1A1NPC1 | |
| SCHEMBL11540202 | 0.83 | S100A4 (0.50) | S100A4PDK2MAPTALDH1A1NPC1 | |
| SCHEMBL881323 | 0.83 | MAPT (0.59) | S100A4MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL11538800 | 0.83 | MAOB (0.50) | S100A4MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL11541429 | 0.81 | L3MBTL1 (0.49) | S100A4PDK2MAPTALDH1A1RAB9A | |
| SCHEMBL14925354 | 0.79 | PDK2 (0.51) | S100A4PDK2MAPTALDH1A1NPC1 | |
| SCHEMBL658959 | 0.77 | HSD17B14 (0.53) | MAPTNPC1RAB9AHSD17B1PKM | |
| SCHEMBL29818197 | 0.77 | HSD17B14 (0.53) | MAPTNPC1RAB9AHSD17B1PKM | |
| SCHEMBL19318873 | 0.77 | ALDH1A1 (0.46) | S100A4MAPTALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4153807-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS | THE BOOTS COMPANY LIMITED (GB) | 1979-05-08 | — | — | US | disclosed |
| US-4048332-A | Phenylalkanoic acids | THE BOOTS COMPANY LIMITED (EN) | 1977-09-13 | — | — | US | disclosed |