Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | BLM | P54132 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL8580642 | 0.80 | PTGS2 (0.57) | ALDH1A1CYP1A2KMT2AMEN1PTGS2 | |
| SCHEMBL8991939 | 0.74 | PTGS2 (0.44) | MAPTMAPK1TP53NFKB1ALDH1A1 | |
| SCHEMBL9027935 | 0.74 | PTGS2 (0.44) | MAPTMAPK1TP53NFKB1ALDH1A1 | |
| SCHEMBL8580713 | 0.73 | ALDH1A1 (0.42) | MAPTMAPK1TP53NFKB1ALDH1A1 | |
| SCHEMBL8581179 | 0.73 | PTGS2 (0.49) | MAPTMAPK1TP53NFKB1NPC1 | |
| SCHEMBL8580941 | 0.71 | TP53 (0.45) | MAPTMAPK1TP53NFKB1NPC1 | |
| SCHEMBL8895700 | 0.70 | ALDH1A1 (0.42) | MAPTMAPK1TP53NFKB1ALDH1A1 | |
| SCHEMBL8580683 | 0.70 | ALDH1A1 (0.40) | MAPTMAPK1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL4729051 | 0.69 | ALDH1A1 (0.65) | MAPTMAPK1TP53NFKB1SMN1; SMN2 | |
| SCHEMBL8908613 | 0.69 | PTGS2 (0.41) | MAPTMAPK1TP53NFKB1NPC1 |
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-5731336-A | USING ARYL-SUBSTITUTED RHODAMINES | ELI LILLY AND COMPANY (US) | 1998-03-24 | — | — | US | disclosed |