Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 2/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9756582 | 0.82 | CYP2A6 (0.47) | BACE1ALDH1A1MAPTTP53KMT2A | |
| SCHEMBL27613022 | 0.79 | CYP2A6 (0.37) | BACE1ALDH1A1MAPTTP53CYP2A6 | |
| SCHEMBL28908860 | 0.76 | TDP1 (0.47) | ALDH1A1MAPTTP53CDK4CCND1 | |
| SCHEMBL28908861 | 0.76 | TDP1 (0.47) | ALDH1A1MAPTTP53CDK4CCND1 | |
| SCHEMBL20074265 | 0.73 | CDK4 (0.37) | ALDH1A1MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL21667412 | 0.71 | BACE1 (0.41) | BACE1ALDH1A1MAPTPTGS2CDK4 | |
| SCHEMBL1002405 | 0.71 | TDP1 (0.55) | BACE1ALDH1A1MAPTSLC2A1CYP2A6 | |
| SCHEMBL29848301 | 0.71 | TDP1 (0.55) | BACE1ALDH1A1MAPTSLC2A1CYP2A6 | |
| SCHEMBL374619 | 0.70 | APP (0.72) | ALDH1A1MAPTKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL351371 | 0.70 | APP (0.72) | ALDH1A1MAPTKMT2ASMN1; SMN2MEN1 |
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-4173649-A | ANTIULCER AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1979-11-06 | — | — | US | disclosed |